#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b9n s GLN 2 N 0.00 4.24 -0.14 2.12 1.11 -1.26 -5.00 119.66 120.72 1b9n s GLN 2 Ca 0.00 2.35 -0.08 0.00 0.01 0.00 0.00 55.36 57.64 1b9n s GLN 2 Cb 0.00 -3.11 0.05 0.00 -1.01 0.00 0.00 33.01 28.94 1b9n s GLN 2 CO 0.00 -0.49 0.34 0.00 0.01 0.00 0.00 175.29 175.15 1b9n s ALA 3 N 0.28 -0.84 0.16 6.09 0.00 -1.26 -5.17 121.76 121.02 1b9n s ALA 3 Ca 0.62 1.28 -0.07 0.00 0.00 0.00 0.00 51.96 53.79 1b9n s ALA 3 Cb -0.43 -0.78 -0.02 0.00 0.00 0.00 0.00 23.12 21.89 1b9n s ALA 3 CO 0.41 -0.23 0.23 -1.83 0.00 0.00 0.00 175.76 174.33 1b9n s GLU 4 N 1.23 1.11 -0.06 0.00 -1.05 -1.26 -4.91 118.70 113.76 1b9n s GLU 4 Ca -0.09 -1.26 0.05 0.00 -0.15 0.00 0.00 54.97 53.53 1b9n s GLU 4 Cb -0.09 0.34 -0.01 0.00 -0.44 0.00 0.00 34.13 33.94 1b9n s GLU 4 CO -0.10 -0.39 -0.23 0.42 0.95 0.00 0.00 175.26 175.91 1b9n s ILE 5 N -4.00 1.93 -0.09 1.83 1.01 -1.26 -5.13 121.20 115.50 1b9n s ILE 5 Ca 0.20 -0.99 0.02 0.00 0.00 0.00 0.00 60.65 59.88 1b9n s ILE 5 Cb 0.04 -1.64 -0.02 0.00 0.01 0.00 0.00 42.46 40.85 1b9n s ILE 5 CO 0.01 0.54 -0.15 -0.76 0.00 0.00 0.00 174.94 174.58 1b9n s LEU 6 N -0.04 2.63 -0.09 2.97 1.43 -1.26 -4.90 118.68 119.41 1b9n s LEU 6 Ca -0.06 -0.30 0.01 0.00 -1.03 0.00 0.00 54.13 52.75 1b9n s LEU 6 Cb -0.14 -1.55 -0.02 0.00 0.03 0.00 0.00 46.19 44.50 1b9n s LEU 6 CO 0.04 0.25 -0.12 -0.22 0.23 0.00 0.00 176.35 176.53 1b9n s LEU 7 N -0.15 2.85 -0.03 1.79 2.96 -1.26 -5.08 118.68 119.75 1b9n s LEU 7 Ca -0.01 -0.21 0.05 0.00 -0.22 0.00 0.00 54.13 53.74 1b9n s LEU 7 Cb -0.14 -1.62 -0.01 0.00 0.50 0.00 0.00 46.19 44.93 1b9n s LEU 7 CO 0.03 0.27 -0.20 -0.89 -1.32 0.00 0.00 176.35 174.24 1b9n s THR 8 N -0.24 1.59 -0.08 3.68 2.01 -1.26 -4.01 115.64 117.32 1b9n s THR 8 Ca 0.02 -0.83 0.01 0.00 0.31 0.00 0.00 61.69 61.19 1b9n s THR 8 Cb -0.13 -1.34 -0.03 0.00 0.01 0.00 0.00 72.50 71.01 1b9n s THR 8 CO 0.03 0.45 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.56 1b9n s LEU 9 N -0.24 3.02 0.06 4.42 1.43 0.09 -4.98 118.68 122.48 1b9n s LEU 9 Ca 0.02 -0.11 0.06 0.00 -1.03 0.00 0.00 54.13 53.07 1b9n s LEU 9 Cb -0.10 -1.66 -0.03 0.00 0.03 0.00 0.00 46.19 44.44 1b9n s LEU 9 CO 0.01 0.32 -0.18 -0.54 0.23 0.00 0.00 176.35 176.19 1b9n s LYS 10 N -0.53 1.10 -0.02 1.70 1.02 -1.26 -1.34 119.74 120.42 1b9n s LYS 10 Ca 0.08 -0.92 0.02 0.00 0.02 0.00 0.00 55.97 55.16 1b9n s LYS 10 Cb -0.12 -1.20 0.00 0.00 -0.52 0.00 0.00 37.83 35.99 1b9n s LYS 10 CO 0.02 0.29 -0.06 -0.51 -0.92 0.00 0.00 175.35 174.17 1b9n s LEU 11 N -1.39 1.82 -1.48 3.17 1.43 0.22 -4.78 118.68 117.67 1b9n s LEU 11 Ca 0.04 -0.12 -0.07 0.00 -1.03 0.00 0.00 54.13 52.95 1b9n s LEU 11 Cb -0.09 -0.36 0.02 0.00 0.03 0.00 0.00 46.19 45.79 1b9n s LEU 11 CO 0.02 0.04 0.78 0.00 0.23 0.00 0.00 176.35 177.43 1b9n n GLN 12 N 3.23 -5.61 -1.28 1.70 6.02 -1.26 0.46 117.38 120.64 1b9n n GLN 12 Ca -0.17 0.81 -0.10 0.00 -0.01 0.00 0.00 57.00 57.54 1b9n n GLN 12 Cb 0.56 -5.71 -0.04 0.00 1.02 0.00 0.00 30.24 26.06 1b9n n GLN 12 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1b9n n GLN 13 N -4.32 -1.74 -4.42 -1.09 6.02 -1.26 -4.98 117.38 105.59 1b9n n GLN 13 Ca -0.05 0.83 -0.27 0.00 -0.01 0.00 0.00 57.00 57.50 1b9n n GLN 13 Cb 0.59 -5.27 -0.09 0.00 1.02 0.00 0.00 30.24 26.48 1b9n n GLN 13 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1b9n s LYS 14 N -2.80 2.10 -0.16 -1.09 1.02 0.17 -5.09 119.74 113.89 1b9n s LYS 14 Ca 0.00 -2.04 -0.29 0.00 0.02 0.00 0.00 55.97 53.66 1b9n s LYS 14 Cb 0.00 -1.78 -0.04 0.00 -0.52 0.00 0.00 37.83 35.50 1b9n s LYS 14 CO 0.00 -0.13 1.64 -1.17 -0.92 0.00 0.00 175.35 174.77 1b9n s LEU 15 N -3.83 4.04 -0.13 3.17 2.96 -1.26 -0.61 118.68 123.02 1b9n s LEU 15 Ca 0.34 1.85 -0.15 0.00 -0.22 0.00 0.00 54.13 55.96 1b9n s LEU 15 Cb 0.06 -3.53 -0.05 0.00 0.50 0.00 0.00 46.19 43.17 1b9n s LEU 15 CO 0.18 -1.15 -0.29 0.33 -1.32 0.00 0.00 176.35 174.11 1b9n n PHE 16 N 8.03 0.00 -4.17 5.38 7.35 -0.45 -4.84 117.46 128.76 1b9n n PHE 16 Ca 0.18 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.74 1b9n n PHE 16 Cb 0.44 -0.42 -0.11 0.00 0.35 0.00 0.00 39.48 39.74 1b9n n PHE 16 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1b9n s ALA 17 N -2.74 1.07 -0.01 3.13 0.00 -0.78 -4.75 121.76 117.68 1b9n s ALA 17 Ca -0.24 -1.24 -0.29 0.00 0.00 0.00 0.00 51.96 50.19 1b9n s ALA 17 Cb 0.04 0.07 0.10 0.00 0.00 0.00 0.00 23.12 23.33 1b9n s ALA 17 CO 0.36 -0.10 0.88 0.16 0.00 0.00 0.00 175.76 177.06 1b9n s ASP 18 N -2.64 -0.38 0.38 0.00 1.47 -1.26 -0.73 116.67 113.51 1b9n s ASP 18 Ca 0.08 0.04 0.16 0.00 1.18 0.00 0.00 52.55 54.00 1b9n s ASP 18 Cb -0.00 0.39 1.03 0.00 -0.34 0.00 0.00 42.92 43.99 1b9n s ASP 18 CO -0.01 -0.61 1.78 -0.65 0.68 0.00 0.00 175.17 176.36 1b9n h PRO 19 N 2.06 0.46 -0.37 2.11 0.11 -1.99 -2.10 132.00 132.28 1b9n h PRO 19 Ca -0.22 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.75 1b9n h PRO 19 Cb 1.24 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 1b9n h PRO 19 CO 0.31 0.30 -0.22 -0.09 -0.21 0.00 0.00 178.00 178.10 1b9n h ARG 20 N 0.47 0.71 -0.25 1.05 9.65 -1.96 -0.21 114.38 123.84 1b9n h ARG 20 Ca 0.58 -0.28 -0.18 0.00 -1.10 0.00 0.00 59.98 59.00 1b9n h ARG 20 Cb 1.34 -0.04 -0.00 0.00 -1.39 0.00 0.00 29.97 29.88 1b9n h ARG 20 CO -0.31 0.87 -0.55 0.00 2.80 0.00 0.00 179.97 182.79 1b9n h ARG 21 N 0.63 0.75 -0.63 0.20 3.08 -1.79 -0.41 114.38 116.20 1b9n h ARG 21 Ca 0.09 -0.47 -0.05 0.00 0.07 0.00 0.00 59.98 59.61 1b9n h ARG 21 Cb 0.70 0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.78 1b9n h ARG 21 CO 0.05 1.10 0.18 0.82 -1.07 0.00 0.00 179.97 181.05 1b9n h ILE 22 N 0.58 1.25 -0.59 2.04 1.08 -1.37 -0.62 117.51 119.88 1b9n h ILE 22 Ca 0.01 -0.87 -0.04 0.00 -0.39 0.00 0.00 64.86 63.57 1b9n h ILE 22 Cb 1.13 0.62 -0.03 0.00 -3.07 0.00 0.00 36.82 35.48 1b9n h ILE 22 CO 0.11 0.33 0.19 -1.28 -0.69 0.00 0.00 178.15 176.82 1b9n h SER 23 N 0.91 0.82 -0.63 1.72 0.87 -0.74 -1.60 113.55 114.89 1b9n h SER 23 Ca 0.20 -0.13 0.04 0.00 -1.23 0.00 0.00 61.79 60.68 1b9n h SER 23 Cb 0.32 -0.21 -0.05 0.00 -0.44 0.00 0.00 62.40 62.02 1b9n h SER 23 CO -0.00 0.76 0.37 0.25 -0.53 0.00 0.00 176.83 177.68 1b9n h LEU 24 N 0.86 0.57 -0.53 2.23 5.85 -0.34 -0.90 115.31 123.06 1b9n h LEU 24 Ca 0.20 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.91 1b9n h LEU 24 Cb 0.24 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 1b9n h LEU 24 CO -0.01 0.38 0.25 -0.07 -0.34 0.00 0.00 178.44 178.65 1b9n h LEU 25 N 0.70 0.70 -0.73 2.25 3.38 -0.70 -0.33 115.31 120.58 1b9n h LEU 25 Ca 0.27 -0.14 -0.11 0.00 0.09 0.00 0.00 57.88 58.00 1b9n h LEU 25 Cb 0.11 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1b9n h LEU 25 CO -0.14 0.64 -0.19 0.11 0.09 0.00 0.00 178.44 178.95 1b9n h LYS 26 N 0.72 0.77 0.00 1.13 1.57 -0.97 -0.86 116.57 118.92 1b9n h LYS 26 Ca 0.18 -0.29 -0.11 0.00 -1.87 0.00 0.00 60.65 58.56 1b9n h LYS 26 Cb 0.13 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 1b9n h LYS 26 CO -0.02 0.90 -0.50 0.45 -0.57 0.00 0.00 179.45 179.71 1b9n h HIS 27 N 0.68 0.00 -0.09 -1.35 3.86 -0.69 -2.18 115.15 115.38 1b9n h HIS 27 Ca 0.10 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.29 1b9n h HIS 27 Cb 0.69 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.16 1b9n h HIS 27 CO 0.04 0.50 -0.01 0.82 0.86 0.00 0.00 177.93 180.13 1b9n h ILE 28 N 0.00 1.28 -0.45 2.45 2.04 -0.66 0.47 117.51 122.64 1b9n h ILE 28 Ca -0.01 -0.89 0.07 0.00 1.00 0.00 0.00 64.86 65.04 1b9n h ILE 28 Cb 0.98 1.69 -0.06 0.00 -0.74 0.00 0.00 36.82 38.69 1b9n h ILE 28 CO 0.07 0.25 0.09 0.00 0.00 0.00 0.00 178.15 178.55 1b9n h ALA 29 N 0.70 0.50 0.11 1.87 0.00 -1.18 -1.23 119.26 120.02 1b9n h ALA 29 Ca 0.02 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1b9n h ALA 29 Cb 0.40 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1b9n h ALA 29 CO 0.01 -0.31 -0.05 -0.07 0.00 0.00 0.00 179.25 178.82 1b9n h LEU 30 N 0.22 -0.13 -0.22 0.00 3.38 -0.93 -3.33 115.31 114.31 1b9n h LEU 30 Ca 0.22 -0.16 -0.15 0.00 0.09 0.00 0.00 57.88 57.88 1b9n h LEU 30 Cb 0.29 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 1b9n h LEU 30 CO -0.29 0.08 -0.73 0.77 0.09 0.00 0.00 178.44 178.36 1b9n h SER 31 N -0.33 0.00 -0.25 -0.43 4.64 -0.83 -3.48 113.55 112.88 1b9n h SER 31 Ca -0.02 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.20 1b9n h SER 31 Cb 0.27 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.32 1b9n h SER 31 CO 0.03 0.73 -0.10 0.61 -0.87 0.00 0.00 176.83 177.23 1b9n n GLY 32 N 1.03 0.78 3.41 -0.77 0.00 -0.47 -4.95 105.19 104.21 1b9n n GLY 32 Ca 0.00 -0.82 -0.15 0.00 0.00 0.00 0.00 46.02 45.06 1b9n n GLY 32 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1b9n s SER 33 N -2.94 -0.47 0.13 1.61 1.04 -1.24 0.28 113.70 112.12 1b9n s SER 33 Ca 0.00 0.32 -0.12 0.00 0.48 0.00 0.00 55.95 56.63 1b9n s SER 33 Cb 0.00 0.48 -0.06 0.00 0.10 0.00 0.00 66.02 66.54 1b9n s SER 33 CO 0.00 -0.65 1.45 0.40 0.98 0.00 0.00 173.24 175.42 1b9n h ILE 34 N 2.99 1.28 -0.09 -1.02 2.04 -1.94 0.20 117.51 120.97 1b9n h ILE 34 Ca -0.30 -1.57 -0.13 0.00 1.00 0.00 0.00 64.86 63.87 1b9n h ILE 34 Cb 1.19 1.46 0.01 0.00 -0.74 0.00 0.00 36.82 38.74 1b9n h ILE 34 CO 0.40 0.52 -0.44 0.77 0.00 0.00 0.00 178.15 179.40 1b9n h SER 35 N 0.69 0.54 -0.43 1.72 4.64 -1.97 0.58 113.55 119.32 1b9n h SER 35 Ca 0.05 -0.65 -0.13 0.00 -0.47 0.00 0.00 61.79 60.60 1b9n h SER 35 Cb 0.99 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.90 1b9n h SER 35 CO 0.09 1.10 -0.21 -0.61 -0.87 0.00 0.00 176.83 176.34 1b9n h GLN 36 N 0.02 0.94 -0.47 4.77 5.75 -1.95 -2.32 115.11 121.85 1b9n h GLN 36 Ca -0.03 -0.39 0.07 0.00 -0.15 0.00 0.00 58.65 58.15 1b9n h GLN 36 Cb 1.09 -0.04 -0.06 0.00 1.07 0.00 0.00 27.48 29.55 1b9n h GLN 36 CO 0.09 1.06 0.13 0.78 -2.65 0.00 0.00 178.83 178.24 1b9n h GLY 37 N 0.90 0.59 0.97 2.39 0.00 0.41 0.52 103.07 108.86 1b9n h GLY 37 Ca 0.11 -0.06 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 1b9n h GLY 37 CO 0.06 -0.02 0.24 0.00 0.00 0.00 0.00 176.54 176.82 1b9n h ALA 38 N 1.34 0.59 0.59 3.60 0.00 0.24 0.72 119.26 126.34 1b9n h ALA 38 Ca 0.23 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1b9n h ALA 38 Cb 0.27 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1b9n h ALA 38 CO -0.27 0.13 -0.32 0.87 0.00 0.00 0.00 179.25 179.66 1b9n h LYS 39 N 0.61 -0.82 -0.98 0.00 1.57 -1.04 0.21 116.57 116.11 1b9n h LYS 39 Ca 0.16 0.06 0.18 0.00 -1.87 0.00 0.00 60.65 59.17 1b9n h LYS 39 Cb 0.07 0.19 -0.09 0.00 0.08 0.00 0.00 32.23 32.48 1b9n h LYS 39 CO -0.02 -0.55 0.61 -0.44 -0.57 0.00 0.00 179.45 178.48 1b9n h ASP 40 N -0.85 0.73 0.45 0.86 3.32 -0.86 0.10 116.42 120.18 1b9n h ASP 40 Ca -0.08 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1b9n h ASP 40 Cb 0.68 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.16 1b9n h ASP 40 CO 0.10 0.30 -0.14 0.00 -1.72 0.00 0.00 179.24 177.78 1b9n n ALA 41 N -2.38 2.79 -0.73 3.45 0.00 0.24 -4.92 120.51 118.96 1b9n n ALA 41 Ca 0.21 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1b9n n ALA 41 Cb 0.55 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.67 1b9n n ALA 41 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b9n n GLY 42 N 1.33 0.69 3.55 0.00 0.00 0.36 -4.91 105.19 106.21 1b9n n GLY 42 Ca 0.13 -0.66 -0.26 0.00 0.00 0.00 0.00 46.02 45.23 1b9n n GLY 42 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1b9n s ILE 43 N -2.00 2.01 0.75 -0.61 -4.36 0.55 -5.01 121.20 112.53 1b9n s ILE 43 Ca 0.00 -2.11 -0.13 0.00 -0.26 0.00 0.00 60.65 58.14 1b9n s ILE 43 Cb 0.00 -2.75 0.05 0.00 1.25 0.00 0.00 42.46 41.00 1b9n s ILE 43 CO 0.00 -0.13 1.15 -0.94 0.24 0.00 0.00 174.94 175.26 1b9n s SER 44 N -3.61 4.30 0.13 4.36 1.04 -1.26 -4.05 113.70 114.61 1b9n s SER 44 Ca 0.33 2.14 -0.21 0.00 0.48 0.00 0.00 55.95 58.69 1b9n s SER 44 Cb 0.06 -2.56 -0.01 0.00 0.10 0.00 0.00 66.02 63.60 1b9n s SER 44 CO 0.16 -2.18 1.68 0.22 0.98 0.00 0.00 173.24 174.10 1b9n h TYR 45 N -0.59 -0.31 -0.60 5.02 3.20 -1.92 -0.34 116.97 121.44 1b9n h TYR 45 Ca -0.46 0.02 0.03 0.00 3.14 0.00 0.00 58.73 61.46 1b9n h TYR 45 Cb 1.27 0.16 -0.03 0.00 1.54 0.00 0.00 36.73 39.67 1b9n h TYR 45 CO 0.51 -0.19 0.40 1.57 -1.64 0.00 0.00 178.16 178.82 1b9n h LYS 46 N -0.13 0.71 -0.18 1.82 2.10 -1.99 -1.11 116.57 117.78 1b9n h LYS 46 Ca 0.10 -0.04 -0.20 0.00 -2.00 0.00 0.00 60.65 58.51 1b9n h LYS 46 Cb 0.28 -0.16 0.00 0.00 -0.90 0.00 0.00 32.23 31.46 1b9n h LYS 46 CO -0.25 0.47 -0.68 1.03 -2.00 0.00 0.00 179.45 178.02 1b9n h SER 47 N 0.73 0.85 -0.92 7.07 0.87 -1.88 0.18 113.55 120.45 1b9n h SER 47 Ca 0.24 -0.51 0.01 0.00 -1.23 0.00 0.00 61.79 60.30 1b9n h SER 47 Cb 0.04 -0.25 -0.05 0.00 -0.44 0.00 0.00 62.40 61.71 1b9n h SER 47 CO -0.06 1.29 0.61 0.00 -0.53 0.00 0.00 176.83 178.14 1b9n h ALA 48 N 0.70 1.17 -0.21 6.23 0.00 -0.60 0.04 119.26 126.59 1b9n h ALA 48 Ca -0.02 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 1b9n h ALA 48 Cb 1.29 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 1b9n h ALA 48 CO 0.14 0.54 -0.03 -1.49 0.00 0.00 0.00 179.25 178.41 1b9n h TRP 49 N 1.23 0.43 -0.66 0.00 4.06 -0.64 -1.62 115.95 118.75 1b9n h TRP 49 Ca 0.34 -0.09 0.06 0.00 2.06 0.00 0.00 58.89 61.27 1b9n h TRP 49 Cb -0.12 -0.11 -0.06 0.00 -1.00 0.00 0.00 29.16 27.88 1b9n h TRP 49 CO -0.01 0.61 0.35 -0.44 -3.56 0.00 0.00 178.44 175.40 1b9n h ASP 50 N 0.13 0.51 0.23 -3.49 3.32 -0.40 -1.02 116.42 115.70 1b9n h ASP 50 Ca 0.06 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.13 1b9n h ASP 50 Cb 0.46 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.95 1b9n h ASP 50 CO 0.02 0.32 -0.11 0.00 -1.72 0.00 0.00 179.24 177.75 1b9n h ALA 51 N 1.36 -0.30 -0.53 3.45 0.00 -0.79 -0.99 119.26 121.46 1b9n h ALA 51 Ca 0.30 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.17 1b9n h ALA 51 Cb 0.22 0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.08 1b9n h ALA 51 CO -0.20 -0.63 0.26 0.82 0.00 0.00 0.00 179.25 179.49 1b9n h ILE 52 N -0.38 0.93 -0.75 0.00 2.04 -1.15 -0.09 117.51 118.11 1b9n h ILE 52 Ca -0.03 -0.17 -0.02 0.00 1.00 0.00 0.00 64.86 65.64 1b9n h ILE 52 Cb 0.29 0.39 -0.04 0.00 -0.74 0.00 0.00 36.82 36.72 1b9n h ILE 52 CO 0.05 0.09 0.38 0.78 0.00 0.00 0.00 178.15 179.46 1b9n h ASN 53 N 0.49 0.95 -0.31 1.72 2.35 -1.17 -1.24 115.58 118.37 1b9n h ASN 53 Ca 0.24 -0.09 -0.12 0.00 -0.55 0.00 0.00 56.30 55.77 1b9n h ASN 53 Cb 0.17 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.29 1b9n h ASN 53 CO -0.18 0.79 -0.28 -0.08 -1.65 0.00 0.00 177.43 176.02 1b9n h GLU 54 N 1.06 0.75 -0.41 0.81 4.81 -0.64 -1.95 114.58 119.00 1b9n h GLU 54 Ca 0.26 -0.38 0.02 0.00 -0.13 0.00 0.00 59.36 59.12 1b9n h GLU 54 Cb 0.07 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.43 1b9n h GLU 54 CO -0.04 1.01 0.25 0.52 -0.73 0.00 0.00 179.01 180.02 1b9n h MET 55 N 0.51 0.49 0.02 1.92 2.86 -0.74 0.62 114.93 120.60 1b9n h MET 55 Ca 0.05 -0.03 0.01 0.00 -2.06 0.00 0.00 59.70 57.68 1b9n h MET 55 Cb 0.85 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 32.38 1b9n h MET 55 CO 0.07 0.32 -0.10 -0.91 1.06 0.00 0.00 176.91 177.36 1b9n h ASN 56 N 0.50 -0.28 0.32 1.22 2.35 -1.23 -0.96 115.58 117.51 1b9n h ASN 56 Ca 0.16 0.04 -0.02 0.00 -0.55 0.00 0.00 56.30 55.94 1b9n h ASN 56 Cb -0.01 0.12 0.00 0.00 0.05 0.00 0.00 38.32 38.48 1b9n h ASN 56 CO -0.07 -0.15 -0.15 -0.61 -1.65 0.00 0.00 177.43 174.80 1b9n h GLN 57 N -0.18 -0.42 -0.30 0.81 -0.00 -1.04 0.11 115.11 114.09 1b9n h GLN 57 Ca 0.03 0.03 -0.11 0.00 -0.00 0.00 0.00 58.65 58.60 1b9n h GLN 57 Cb 0.22 0.09 -0.01 0.00 0.00 0.00 0.00 27.48 27.78 1b9n h GLN 57 CO -0.09 -0.21 -0.26 -0.07 0.00 0.00 0.00 178.83 178.20 1b9n h LEU 58 N -0.54 0.62 0.00 -2.39 3.38 -0.88 -3.12 115.31 112.38 1b9n h LEU 58 Ca -0.04 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 1b9n h LEU 58 Cb 0.40 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 1b9n h LEU 58 CO 0.07 0.86 -0.38 0.77 0.09 0.00 0.00 178.44 179.85 1b9n h SER 59 N 0.53 0.00 -0.48 -0.43 4.64 -1.16 -3.48 113.55 113.18 1b9n h SER 59 Ca 0.07 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.18 1b9n h SER 59 Cb 0.73 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.74 1b9n h SER 59 CO 0.06 0.03 -0.19 -0.62 -0.87 0.00 0.00 176.83 175.24 1b9n n GLU 60 N -2.96 -0.71 -4.32 4.77 1.02 0.36 -4.99 120.64 113.81 1b9n n GLU 60 Ca 0.02 0.85 -0.30 0.00 -0.02 0.00 0.00 57.16 57.72 1b9n n GLU 60 Cb 0.55 -4.78 -0.04 0.00 -0.02 0.00 0.00 31.44 27.15 1b9n n GLU 60 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1b9n n HIS 61 N -2.70 0.47 -4.68 -0.32 8.25 -1.18 -5.04 115.22 110.01 1b9n n HIS 61 Ca -0.10 -2.41 -0.33 0.00 -0.26 0.00 0.00 57.72 54.62 1b9n n HIS 61 Cb 0.33 -0.38 -0.14 0.00 1.12 0.00 0.00 29.99 30.93 1b9n n HIS 61 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1b9n s ILE 62 N -2.77 3.27 -0.16 1.59 -1.09 -1.26 -4.25 121.20 116.54 1b9n s ILE 62 Ca 0.12 -0.58 0.17 0.00 -2.23 0.00 0.00 60.65 58.13 1b9n s ILE 62 Cb -0.01 -2.39 -0.23 0.00 -1.58 0.00 0.00 42.46 38.24 1b9n s ILE 62 CO 0.08 0.52 0.12 0.18 -1.23 0.00 0.00 174.94 174.60 1b9n n LEU 63 N 3.51 0.00 -4.10 2.97 7.99 -1.26 -4.56 117.00 121.55 1b9n n LEU 63 Ca -0.18 0.00 -0.26 0.00 -0.01 0.00 0.00 56.01 55.56 1b9n n LEU 63 Cb 0.53 0.38 -0.16 0.00 -0.11 0.00 0.00 43.42 44.05 1b9n n LEU 63 CO 0.31 0.38 -0.50 -0.69 -1.51 0.00 0.00 177.39 175.39 1b9n s VAL 64 N -2.57 1.40 -0.08 4.08 1.01 -1.26 -1.18 120.40 121.80 1b9n s VAL 64 Ca -0.09 -0.66 0.03 0.00 0.00 0.00 0.00 61.98 61.26 1b9n s VAL 64 Cb 0.06 -1.23 -0.07 0.00 0.00 0.00 0.00 36.38 35.14 1b9n s VAL 64 CO 0.75 0.41 -0.04 -0.62 0.00 0.00 0.00 175.10 175.60 1b9n n GLU 65 N 3.49 1.24 -4.63 2.72 1.02 -1.26 -4.86 120.64 118.37 1b9n n GLU 65 Ca -0.20 0.03 -0.31 0.00 -0.02 0.00 0.00 57.16 56.66 1b9n n GLU 65 Cb 0.52 -1.19 -0.12 0.00 -0.02 0.00 0.00 31.44 30.64 1b9n n GLU 65 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1b9n s ALA 76 N -2.18 2.65 0.21 0.62 0.00 0.80 -4.79 121.76 119.06 1b9n s ALA 76 Ca -0.09 -1.17 0.04 0.00 0.00 0.00 0.00 51.96 50.74 1b9n s ALA 76 Cb 0.03 -0.79 -0.05 0.00 0.00 0.00 0.00 23.12 22.31 1b9n s ALA 76 CO 0.25 0.58 -0.05 0.14 0.00 0.00 0.00 175.76 176.67 1b9n s VAL 77 N -0.94 1.18 0.32 0.00 -7.23 -1.26 -4.39 120.40 108.08 1b9n s VAL 77 Ca 0.15 -2.06 -0.23 0.00 -1.81 0.00 0.00 61.98 58.03 1b9n s VAL 77 Cb -0.11 -2.17 -0.10 0.00 0.56 0.00 0.00 36.38 34.56 1b9n s VAL 77 CO 0.06 -0.48 0.88 -0.76 -0.31 0.00 0.00 175.10 174.49 1b9n s LEU 78 N -3.27 4.26 0.00 1.32 1.43 -1.26 -4.54 118.68 116.62 1b9n s LEU 78 Ca 0.24 1.68 -0.01 0.00 -1.03 0.00 0.00 54.13 55.02 1b9n s LEU 78 Cb 0.04 -4.01 0.01 0.00 0.03 0.00 0.00 46.19 42.26 1b9n s LEU 78 CO 0.06 -0.10 0.04 0.35 0.23 0.00 0.00 176.35 176.93 1b9n n THR 79 N 0.34 0.00 -0.03 5.49 -2.24 -0.32 -4.78 114.28 112.74 1b9n n THR 79 Ca 0.02 -0.02 -0.15 0.00 -2.27 0.00 0.00 64.05 61.63 1b9n n THR 79 Cb 0.51 -1.49 -0.09 0.00 -2.10 0.00 0.00 70.33 67.16 1b9n n THR 79 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1b9n h ARG 80 N 0.00 0.33 -0.77 -0.78 2.43 -1.89 -1.16 114.38 112.55 1b9n h ARG 80 Ca -0.01 -0.26 0.14 0.00 -0.81 0.00 0.00 59.98 59.03 1b9n h ARG 80 Cb 0.04 0.05 -0.09 0.00 -0.42 0.00 0.00 29.97 29.55 1b9n h ARG 80 CO 0.01 0.89 0.33 -0.92 -1.51 0.00 0.00 179.97 178.78 1b9n h TYR 81 N -0.15 0.58 -0.35 2.20 3.20 -1.92 -0.37 116.97 120.16 1b9n h TYR 81 Ca -0.02 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.87 1b9n h TYR 81 Cb 0.94 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 39.05 1b9n h TYR 81 CO 0.13 0.11 0.15 0.78 -1.64 0.00 0.00 178.16 177.68 1b9n h GLY 82 N 0.50 0.56 0.94 1.82 0.00 -1.70 -1.92 103.07 103.27 1b9n h GLY 82 Ca 0.42 -0.30 -0.02 0.00 0.00 0.00 0.00 47.33 47.44 1b9n h GLY 82 CO -0.38 0.28 0.16 1.46 0.00 0.00 0.00 176.54 178.06 1b9n h GLN 83 N 0.42 0.50 0.00 4.80 4.20 -0.62 -2.68 115.11 121.74 1b9n h GLN 83 Ca 0.12 -0.08 -0.02 0.00 0.06 0.00 0.00 58.65 58.73 1b9n h GLN 83 Cb 0.17 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 27.86 1b9n h GLN 83 CO -0.01 0.47 -0.09 0.00 -0.67 0.00 0.00 178.83 178.54 1b9n h ARG 84 N 0.42 0.00 -0.10 1.46 3.08 -0.93 -0.88 114.38 117.42 1b9n h ARG 84 Ca 0.12 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.15 1b9n h ARG 84 Cb 0.14 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.19 1b9n h ARG 84 CO -0.01 0.09 -0.01 1.25 -1.07 0.00 0.00 179.97 180.21 1b9n h LEU 85 N 0.00 0.19 -1.00 3.04 5.85 -1.14 0.16 115.31 122.40 1b9n h LEU 85 Ca -0.00 -0.35 0.04 0.00 0.84 0.00 0.00 57.88 58.41 1b9n h LEU 85 Cb 0.56 -0.05 -0.06 0.00 0.37 0.00 0.00 40.66 41.48 1b9n h LEU 85 CO 0.01 0.49 0.66 0.40 -0.34 0.00 0.00 178.44 179.66 1b9n h ILE 86 N -0.11 1.18 -0.84 4.05 2.04 -1.34 -1.82 117.51 120.67 1b9n h ILE 86 Ca 0.03 -0.44 0.01 0.00 1.00 0.00 0.00 64.86 65.46 1b9n h ILE 86 Cb 0.40 -0.21 -0.04 0.00 -0.74 0.00 0.00 36.82 36.23 1b9n h ILE 86 CO 0.01 0.23 0.56 1.56 0.00 0.00 0.00 178.15 180.51 1b9n h GLN 87 N 1.28 1.11 -0.23 2.37 4.20 -0.83 0.10 115.11 123.11 1b9n h GLN 87 Ca 0.40 -0.07 -0.05 0.00 0.06 0.00 0.00 58.65 58.99 1b9n h GLN 87 Cb -0.01 -0.25 -0.01 0.00 0.30 0.00 0.00 27.48 27.51 1b9n h GLN 87 CO -0.12 0.73 -0.09 1.25 -0.67 0.00 0.00 178.83 179.93 1b9n h LEU 88 N 1.14 0.35 -0.29 1.46 6.46 0.15 -0.77 115.31 123.81 1b9n h LEU 88 Ca 0.31 -0.07 -0.10 0.00 -0.12 0.00 0.00 57.88 57.90 1b9n h LEU 88 Cb -0.13 -0.09 -0.01 0.00 -0.73 0.00 0.00 40.66 39.70 1b9n h LEU 88 CO -0.07 0.48 -0.20 1.88 -0.62 0.00 0.00 178.44 179.91 1b9n h TYR 89 N 0.35 0.76 -0.47 1.25 -1.99 -0.67 -3.04 116.97 113.15 1b9n h TYR 89 Ca 0.07 -0.21 0.02 0.00 2.00 0.00 0.00 58.73 60.61 1b9n h TYR 89 Cb 0.38 -0.17 -0.02 0.00 2.00 0.00 0.00 36.73 38.91 1b9n h TYR 89 CO 0.01 0.91 0.31 -0.44 -0.00 0.00 0.00 178.16 178.95 1b9n h ASP 90 N 0.39 0.50 0.36 3.88 3.32 -0.24 -2.37 116.42 122.25 1b9n h ASP 90 Ca 0.06 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 1b9n h ASP 90 Cb 0.74 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 40.17 1b9n h ASP 90 CO 0.05 0.35 -0.19 0.25 -1.72 0.00 0.00 179.24 177.99 1b9n h LEU 91 N 0.58 -0.46 -0.48 1.55 5.85 -1.05 0.10 115.31 121.40 1b9n h LEU 91 Ca 0.18 0.02 0.10 0.00 0.84 0.00 0.00 57.88 59.02 1b9n h LEU 91 Cb 0.01 0.13 -0.09 0.00 0.37 0.00 0.00 40.66 41.07 1b9n h LEU 91 CO -0.04 -0.32 -0.15 0.25 -0.34 0.00 0.00 178.44 177.84 1b9n h LEU 92 N -0.51 -0.53 -2.19 2.25 5.85 -1.47 -0.53 115.31 118.18 1b9n h LEU 92 Ca -0.04 0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 1b9n h LEU 92 Cb 0.40 0.33 -0.00 0.00 0.37 0.00 0.00 40.66 41.76 1b9n h LEU 92 CO 0.06 -0.19 -0.04 0.00 -0.34 0.00 0.00 178.44 177.93 1b9n h ALA 93 N 1.40 1.12 0.04 1.25 0.00 -1.08 -1.08 119.26 120.91 1b9n h ALA 93 Ca 0.23 -0.04 -0.22 0.00 0.00 0.00 0.00 54.91 54.88 1b9n h ALA 93 Cb 0.39 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1b9n h ALA 93 CO -0.51 0.05 -1.01 1.96 0.00 0.00 0.00 179.25 179.74 1b9n h GLN 94 N 0.00 0.18 -0.01 0.00 1.08 0.77 -3.27 115.11 113.86 1b9n h GLN 94 Ca -0.00 -0.25 0.00 0.00 -1.45 0.00 0.00 58.65 56.95 1b9n h GLN 94 Cb 0.25 0.08 0.00 0.00 -0.05 0.00 0.00 27.48 27.77 1b9n h GLN 94 CO 0.01 1.04 -0.43 0.44 -0.95 0.00 0.00 178.83 178.94 1b9n n ILE 95 N -3.56 0.00 -0.33 2.54 -5.35 -0.70 -4.50 119.36 107.46 1b9n n ILE 95 Ca -0.04 -0.29 0.02 0.00 -0.27 0.00 0.00 62.75 62.17 1b9n n ILE 95 Cb 0.90 1.24 0.20 0.00 -1.74 0.00 0.00 39.64 40.23 1b9n n ILE 95 CO 0.00 0.00 0.00 0.06 -1.76 0.00 0.00 176.55 174.85 1b9n h GLN 96 N 2.25 1.11 -0.07 6.28 3.07 -1.27 -0.99 115.11 125.49 1b9n h GLN 96 Ca 0.00 -0.07 -0.18 0.00 0.09 0.00 0.00 58.65 58.49 1b9n h GLN 96 Cb 0.69 -0.25 -0.01 0.00 0.08 0.00 0.00 27.48 28.00 1b9n h GLN 96 CO 0.00 0.73 -0.73 0.37 0.09 0.00 0.00 178.83 179.30 1b9n h GLN 97 N 1.14 0.36 -0.28 0.06 5.75 -1.83 -0.61 115.11 119.70 1b9n h GLN 97 Ca 0.39 -0.30 -0.00 0.00 -0.15 0.00 0.00 58.65 58.59 1b9n h GLN 97 Cb 0.09 0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.69 1b9n h GLN 97 CO -0.13 0.94 0.16 0.87 -2.65 0.00 0.00 178.83 178.01 1b9n h LYS 98 N 0.25 0.38 -0.70 1.69 1.57 -1.75 -0.97 116.57 117.03 1b9n h LYS 98 Ca -0.03 -0.04 0.04 0.00 -1.87 0.00 0.00 60.65 58.75 1b9n h LYS 98 Cb 1.30 -0.08 -0.05 0.00 0.08 0.00 0.00 32.23 33.48 1b9n h LYS 98 CO 0.12 0.32 0.42 0.00 -0.57 0.00 0.00 179.45 179.75 1b9n h ALA 99 N 1.04 0.93 -0.17 3.86 0.00 -0.93 -0.54 119.26 123.45 1b9n h ALA 99 Ca 0.10 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 1b9n h ALA 99 Cb 0.05 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1b9n h ALA 99 CO -0.02 0.16 -0.25 0.74 0.00 0.00 0.00 179.25 179.88 1b9n h PHE 100 N 0.80 0.34 -0.17 0.00 0.04 -0.73 -0.58 116.94 116.64 1b9n h PHE 100 Ca 0.30 -0.07 -0.18 0.00 2.80 0.00 0.00 57.97 60.82 1b9n h PHE 100 Cb 0.10 -0.09 -0.00 0.00 2.20 0.00 0.00 35.95 38.16 1b9n h PHE 100 CO -0.05 0.55 -0.64 -0.44 -0.60 0.00 0.00 178.31 177.13 1b9n h ASP 101 N 0.28 0.72 -0.73 2.17 3.32 -0.97 -1.30 116.42 119.91 1b9n h ASP 101 Ca 0.04 -0.42 -0.02 0.00 0.02 0.00 0.00 57.03 56.65 1b9n h ASP 101 Cb 0.60 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.91 1b9n h ASP 101 CO 0.04 1.17 0.37 0.58 -1.72 0.00 0.00 179.24 179.68 1b9n h VAL 102 N 0.46 1.23 -0.52 -1.35 2.07 -0.79 -2.73 116.25 114.63 1b9n h VAL 102 Ca -0.01 -0.63 -0.10 0.00 0.82 0.00 0.00 66.70 66.78 1b9n h VAL 102 Cb 1.21 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 1b9n h VAL 102 CO 0.12 0.27 -0.07 0.25 0.02 0.00 0.00 177.57 178.16 1b9n h LEU 103 N 1.02 0.92 -0.60 2.57 5.85 -0.96 -3.01 115.31 121.10 1b9n h LEU 103 Ca 0.25 -0.28 0.00 0.00 0.84 0.00 0.00 57.88 58.70 1b9n h LEU 103 Cb 0.09 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 40.87 1b9n h LEU 103 CO -0.04 1.02 0.00 -1.54 -0.34 0.00 0.00 178.44 177.54 1b9n n SER 104 N -4.16 0.91 -4.58 1.25 3.41 -0.50 -4.71 113.62 105.23 1b9n n SER 104 Ca 0.02 -1.40 -0.39 0.00 -0.26 0.00 0.00 58.87 56.84 1b9n n SER 104 Cb 0.37 -0.02 -0.02 0.00 -0.26 0.00 0.00 64.21 64.28 1b9n n SER 104 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1b9n s ASP 105 N -1.85 6.34 0.60 4.04 -1.08 -1.05 -4.84 116.67 118.83 1b9n s ASP 105 Ca 0.38 -2.17 0.30 0.00 -0.52 0.00 0.00 52.55 50.54 1b9n s ASP 105 Cb 0.19 -2.58 1.72 0.00 -1.46 0.00 0.00 42.92 40.79 1b9n s ASP 105 CO 0.31 -1.69 2.11 0.44 0.52 0.00 0.00 175.17 176.86 1b9n h ASP 106 N 8.28 0.00 0.92 -0.34 3.32 -1.89 -2.45 116.42 124.26 1b9n h ASP 106 Ca 0.37 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.42 1b9n h ASP 106 Cb 0.90 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.45 1b9n h ASP 106 CO 1.40 0.00 -0.59 0.44 -1.72 0.00 0.00 179.24 178.77 1b9n h ASP 107 N 0.00 0.00 -4.10 6.45 3.32 -1.99 -3.47 116.42 116.64 1b9n h ASP 107 Ca 0.07 -0.19 -0.52 0.00 0.02 0.00 0.00 57.03 56.41 1b9n h ASP 107 Cb 0.46 0.00 0.10 0.00 0.22 0.00 0.00 39.33 40.11 1b9n h ASP 107 CO -0.00 0.10 0.46 0.00 -1.72 0.00 0.00 179.24 178.08 1b9n s ALA 108 N -3.17 2.58 1.27 3.45 0.00 -0.93 -5.04 121.76 119.93 1b9n s ALA 108 Ca 0.06 0.96 -0.19 0.00 0.00 0.00 0.00 51.96 52.79 1b9n s ALA 108 Cb 0.13 -3.43 0.31 0.00 0.00 0.00 0.00 23.12 20.14 1b9n s ALA 108 CO 0.71 -1.06 1.02 -0.51 0.00 0.00 0.00 175.76 175.92 1b9n s LEU 109 N -4.01 0.03 0.45 0.00 2.01 -1.26 -4.93 118.68 110.98 1b9n s LEU 109 Ca 0.76 0.94 -0.25 0.00 0.01 0.00 0.00 54.13 55.60 1b9n s LEU 109 Cb -0.29 -2.62 -0.08 0.00 0.01 0.00 0.00 46.19 43.22 1b9n s LEU 109 CO 0.31 -4.59 1.33 -2.84 1.01 0.00 0.00 176.35 171.58 1b9n s PRO 110 N -5.04 3.71 -0.07 1.29 0.02 -1.26 -4.87 135.00 128.77 1b9n s PRO 110 Ca 0.69 2.20 -0.30 0.00 0.02 0.00 0.00 61.00 63.61 1b9n s PRO 110 Cb -0.15 -2.59 -0.04 0.00 0.02 0.00 0.00 34.50 31.74 1b9n s PRO 110 CO 0.59 -0.72 1.36 -1.17 -0.33 0.00 0.00 177.00 176.72 1b9n s LEU 111 N -2.79 4.26 -0.08 -5.54 2.96 -1.26 -4.92 118.68 111.31 1b9n s LEU 111 Ca 0.62 1.94 -0.08 0.00 -0.22 0.00 0.00 54.13 56.38 1b9n s LEU 111 Cb -0.39 -3.55 -0.03 0.00 0.50 0.00 0.00 46.19 42.73 1b9n s LEU 111 CO 0.49 -0.74 -0.15 -3.20 -1.32 0.00 0.00 176.35 171.43 1b9n n ASN 112 N 6.04 0.89 -3.97 3.68 5.15 -1.26 -5.00 115.26 120.79 1b9n n ASN 112 Ca 0.14 0.20 -0.29 0.00 -0.60 0.00 0.00 54.58 54.03 1b9n n ASN 112 Cb 0.44 -0.62 -0.17 0.00 -0.53 0.00 0.00 39.78 38.91 1b9n n ASN 112 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1b9n s SER 113 N -4.83 2.61 0.13 1.20 0.15 -1.26 -5.02 113.70 106.69 1b9n s SER 113 Ca -0.12 -0.49 -0.12 0.00 0.70 0.00 0.00 55.95 55.92 1b9n s SER 113 Cb 0.02 -1.06 -0.03 0.00 -1.71 0.00 0.00 66.02 63.24 1b9n s SER 113 CO 0.18 -0.10 1.50 0.25 1.20 0.00 0.00 173.24 176.28 1b9n h LEU 114 N 8.09 0.91 -0.98 3.45 5.85 -1.94 -0.15 115.31 130.53 1b9n h LEU 114 Ca -0.33 -0.42 -0.00 0.00 0.84 0.00 0.00 57.88 57.96 1b9n h LEU 114 Cb 1.13 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 41.86 1b9n h LEU 114 CO 0.47 1.14 0.56 -0.07 -0.34 0.00 0.00 178.44 180.20 1b9n h LEU 115 N 0.69 1.12 -0.56 2.25 3.38 -1.95 -2.00 115.31 118.23 1b9n h LEU 115 Ca 0.08 -0.07 -0.10 0.00 0.09 0.00 0.00 57.88 57.89 1b9n h LEU 115 Cb 0.82 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 1b9n h LEU 115 CO 0.07 0.85 -0.04 0.00 0.09 0.00 0.00 178.44 179.42 1b9n h ALA 116 N 1.34 0.76 -0.51 1.53 0.00 -1.87 -2.46 119.26 118.05 1b9n h ALA 116 Ca 0.33 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1b9n h ALA 116 Cb -0.06 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1b9n h ALA 116 CO -0.06 0.63 0.22 0.00 0.00 0.00 0.00 179.25 180.03 1b9n h ALA 117 N 0.96 0.66 0.00 0.00 0.00 -0.99 0.19 119.26 120.07 1b9n h ALA 117 Ca 0.16 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1b9n h ALA 117 Cb 0.59 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1b9n h ALA 117 CO 0.04 0.25 0.00 0.44 0.00 0.00 0.00 179.25 179.98 1b9n n ILE 118 N -4.57 0.08 0.17 0.00 -5.35 -0.76 -3.84 119.36 105.10 1b9n n ILE 118 Ca 0.02 0.02 0.02 0.00 -0.27 0.00 0.00 62.75 62.54 1b9n n ILE 118 Cb 0.14 -0.56 -0.02 0.00 -1.74 0.00 0.00 39.64 37.47 1b9n n ILE 118 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 1b9n n SER 119 N -1.29 0.17 -0.02 7.28 2.88 -0.86 -4.51 113.62 117.27 1b9n n SER 119 Ca 0.13 -0.59 -0.09 0.00 -1.33 0.00 0.00 58.87 57.00 1b9n n SER 119 Cb 0.23 1.00 -0.03 0.00 -0.75 0.00 0.00 64.21 64.65 1b9n n SER 119 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 1b9n h ARG 120 N 0.00 -0.07 -0.15 -1.46 -0.00 -0.75 -2.69 114.38 109.26 1b9n h ARG 120 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.48 1b9n h ARG 120 Cb 0.08 0.02 0.00 0.00 0.00 0.00 0.00 29.97 30.07 1b9n h ARG 120 CO 0.00 -0.04 0.00 1.19 0.00 0.00 0.00 179.97 181.12 1b9n n PHE 121 N -5.23 0.17 -0.05 3.04 3.72 -1.26 -4.48 117.46 113.37 1b9n n PHE 121 Ca -0.03 -0.11 -0.05 0.00 -0.05 0.00 0.00 57.45 57.21 1b9n n PHE 121 Cb 0.15 -0.00 -0.08 0.00 -0.94 0.00 0.00 39.48 38.61 1b9n n PHE 121 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1b9n n SER 122 N 1.15 2.47 -4.65 4.37 2.88 -1.20 -4.97 113.62 113.67 1b9n n SER 122 Ca 0.13 -0.00 -0.43 0.00 -1.33 0.00 0.00 58.87 57.25 1b9n n SER 122 Cb 0.51 0.72 -0.03 0.00 -0.75 0.00 0.00 64.21 64.66 1b9n n SER 122 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 1b9n s LEU 123 N -4.80 4.10 0.23 2.46 0.20 -1.02 -4.99 118.68 114.86 1b9n s LEU 123 Ca -0.06 1.88 0.07 0.00 0.69 0.00 0.00 54.13 56.72 1b9n s LEU 123 Cb 0.03 -3.53 -0.05 0.00 -0.43 0.00 0.00 46.19 42.21 1b9n s LEU 123 CO 0.42 -1.07 -0.11 -1.10 -0.29 0.00 0.00 176.35 174.19 1b9n s GLN 124 N 4.30 1.40 0.39 1.98 -1.52 -1.26 -4.98 119.66 119.98 1b9n s GLN 124 Ca 0.71 -1.66 0.04 0.00 -1.95 0.00 0.00 55.36 52.50 1b9n s GLN 124 Cb -0.28 -1.12 -0.05 0.00 -0.22 0.00 0.00 33.01 31.34 1b9n s GLN 124 CO 0.28 0.13 0.05 0.95 -0.25 0.00 0.00 175.29 176.45 1b9n s THR 125 N -3.00 1.23 -1.48 -0.19 -4.23 -1.26 -5.03 115.64 101.68 1b9n s THR 125 Ca 0.25 -2.00 0.26 0.00 -1.18 0.00 0.00 61.69 59.02 1b9n s THR 125 Cb 0.01 -2.63 0.18 0.00 1.34 0.00 0.00 72.50 71.40 1b9n s THR 125 CO 0.09 0.00 1.53 -1.54 -0.54 0.00 0.00 174.62 174.16 1b9n n SER 126 N -0.98 0.80 -4.75 3.99 3.41 -1.26 -4.84 113.62 109.99 1b9n n SER 126 Ca -0.07 -0.64 -0.41 0.00 -0.26 0.00 0.00 58.87 57.50 1b9n n SER 126 Cb 0.66 0.16 -0.03 0.00 -0.26 0.00 0.00 64.21 64.75 1b9n n SER 126 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1b9n s ALA 127 N -2.68 3.49 -0.36 7.33 0.00 -1.26 -4.91 121.76 123.38 1b9n s ALA 127 Ca 0.20 1.13 0.23 0.00 0.00 0.00 0.00 51.96 53.52 1b9n s ALA 127 Cb 0.19 -3.45 0.41 0.00 0.00 0.00 0.00 23.12 20.27 1b9n s ALA 127 CO 0.58 -0.51 1.63 0.00 0.00 0.00 0.00 175.76 177.47 1b9n h ARG 128 N 4.35 0.00 -4.81 0.00 2.47 -1.89 -3.39 114.38 111.11 1b9n h ARG 128 Ca -0.47 0.00 -0.68 0.00 -1.26 0.00 0.00 59.98 57.58 1b9n h ARG 128 Cb 1.22 0.00 -0.26 0.00 -1.65 0.00 0.00 29.97 29.28 1b9n h ARG 128 CO 0.71 0.05 -0.62 -0.80 0.56 0.00 0.00 179.97 179.87 1b9n s ASN 129 N -6.19 5.16 -0.24 7.04 0.01 -1.09 -4.77 114.94 114.87 1b9n s ASN 129 Ca 0.06 -0.68 -0.04 0.00 -0.71 0.00 0.00 52.86 51.49 1b9n s ASN 129 Cb 0.06 -1.89 0.09 0.00 0.41 0.00 0.00 41.25 39.92 1b9n s ASN 129 CO 0.67 -0.19 0.16 -1.58 -1.51 0.00 0.00 177.10 174.65 1b9n s GLN 130 N 1.51 0.17 0.14 -0.60 0.74 -1.26 -1.51 119.66 118.86 1b9n s GLN 130 Ca 0.03 -0.18 0.07 0.00 0.05 0.00 0.00 55.36 55.33 1b9n s GLN 130 Cb -0.17 -1.29 -0.04 0.00 1.10 0.00 0.00 33.01 32.61 1b9n s GLN 130 CO 0.03 -0.84 -0.16 -1.58 -0.55 0.00 0.00 175.29 172.18 1b9n s TRP 131 N 2.20 1.63 0.06 1.67 0.51 -0.43 -4.95 118.94 119.63 1b9n s TRP 131 Ca 0.07 -0.51 0.02 0.00 -2.12 0.00 0.00 56.10 53.56 1b9n s TRP 131 Cb -0.16 -0.83 -0.04 0.00 -0.81 0.00 0.00 33.47 31.63 1b9n s TRP 131 CO -0.23 0.24 0.11 -0.06 -0.51 0.00 0.00 176.95 176.50 1b9n s PHE 132 N -2.04 3.28 0.33 -1.98 0.08 -1.26 -0.01 117.98 116.38 1b9n s PHE 132 Ca 0.12 0.14 -0.10 0.00 0.12 0.00 0.00 56.93 57.21 1b9n s PHE 132 Cb -0.06 -1.67 0.04 0.00 -0.57 0.00 0.00 43.02 40.76 1b9n s PHE 132 CO 0.05 0.54 0.61 0.41 -0.10 0.00 0.00 175.22 176.73 1b9n n GLY 133 N 0.53 1.42 3.08 4.36 0.00 -0.49 -2.57 105.19 111.52 1b9n n GLY 133 Ca -0.08 -1.32 -0.19 0.00 0.00 0.00 0.00 46.02 44.43 1b9n n GLY 133 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1b9n s THR 134 N -2.37 0.87 -0.35 2.61 -4.23 -0.11 0.42 115.64 112.47 1b9n s THR 134 Ca 0.17 -0.74 -0.28 0.00 -1.18 0.00 0.00 61.69 59.66 1b9n s THR 134 Cb -0.03 -0.78 -0.03 0.00 1.34 0.00 0.00 72.50 72.99 1b9n s THR 134 CO 0.12 0.04 2.00 -0.63 -0.54 0.00 0.00 174.62 175.61 1b9n s ILE 135 N -0.64 3.27 0.60 2.99 -1.09 -0.90 -0.70 121.20 124.74 1b9n s ILE 135 Ca 0.01 0.26 0.00 0.00 -2.23 0.00 0.00 60.65 58.69 1b9n s ILE 135 Cb -0.06 -3.43 0.06 0.00 -1.58 0.00 0.00 42.46 37.45 1b9n s ILE 135 CO 0.00 -0.31 0.84 0.42 -1.23 0.00 0.00 174.94 174.66 1b9n s THR 136 N 8.19 2.52 -0.50 2.92 -4.23 -0.84 0.67 115.64 124.37 1b9n s THR 136 Ca 0.86 -0.62 -0.20 0.00 -1.18 0.00 0.00 61.69 60.56 1b9n s THR 136 Cb -0.24 -2.90 0.05 0.00 1.34 0.00 0.00 72.50 70.76 1b9n s THR 136 CO 0.32 0.00 0.64 0.00 -0.54 0.00 0.00 174.62 175.04 1b9n s ALA 137 N -2.88 3.37 -0.44 3.99 0.00 -1.26 -4.53 121.76 119.99 1b9n s ALA 137 Ca 0.59 -1.63 -0.28 0.00 0.00 0.00 0.00 51.96 50.65 1b9n s ALA 137 Cb -0.09 -3.36 -0.00 0.00 0.00 0.00 0.00 23.12 19.67 1b9n s ALA 137 CO 0.40 -1.99 1.62 -1.14 0.00 0.00 0.00 175.76 174.65 1b9n s GLN 145 N 2.72 3.29 0.24 0.00 0.74 -1.26 -4.79 119.66 120.60 1b9n s GLN 145 Ca 0.17 0.96 -0.16 0.00 0.05 0.00 0.00 55.36 56.38 1b9n s GLN 145 Cb -0.18 -4.16 0.06 0.00 1.10 0.00 0.00 33.01 29.83 1b9n s GLN 145 CO 0.13 -1.92 0.80 -2.39 -0.55 0.00 0.00 175.29 171.36 1b9n n HIS 146 N 10.10 -1.66 -4.29 1.67 -0.00 -1.23 -2.08 115.22 117.72 1b9n n HIS 146 Ca 0.19 -1.32 -0.16 0.00 -0.00 0.00 0.00 57.72 56.42 1b9n n HIS 146 Cb 0.48 0.65 -0.10 0.00 -0.00 0.00 0.00 29.99 31.03 1b9n n HIS 146 CO 0.00 0.00 0.00 0.14 -0.00 0.00 0.00 176.34 176.48 1b9n s VAL 147 N -2.17 1.36 -0.03 0.61 -7.23 -0.54 -4.86 120.40 107.54 1b9n s VAL 147 Ca 0.17 -2.11 0.01 0.00 -1.81 0.00 0.00 61.98 58.24 1b9n s VAL 147 Cb -0.03 -1.97 -0.03 0.00 0.56 0.00 0.00 36.38 34.90 1b9n s VAL 147 CO 0.07 -0.65 -0.01 -1.81 -0.31 0.00 0.00 175.10 172.39 1b9n s ASP 148 N -3.24 5.04 -0.04 4.85 1.01 -1.26 -1.28 116.67 121.76 1b9n s ASP 148 Ca 0.20 0.02 0.04 0.00 0.71 0.00 0.00 52.55 53.52 1b9n s ASP 148 Cb 0.02 -1.32 -0.00 0.00 1.01 0.00 0.00 42.92 42.62 1b9n s ASP 148 CO 0.04 0.32 -0.18 -0.69 0.21 0.00 0.00 175.17 174.87 1b9n s VAL 149 N -0.99 1.46 -0.20 -1.27 1.01 0.18 -1.99 120.40 118.60 1b9n s VAL 149 Ca 0.17 -0.74 -0.08 0.00 0.00 0.00 0.00 61.98 61.33 1b9n s VAL 149 Cb -0.11 -1.25 -0.04 0.00 0.00 0.00 0.00 36.38 34.97 1b9n s VAL 149 CO 0.07 0.42 0.09 -0.22 0.00 0.00 0.00 175.10 175.46 1b9n s LEU 150 N -0.02 3.90 1.06 3.92 0.20 0.13 0.41 118.68 128.28 1b9n s LEU 150 Ca -0.03 0.09 -0.16 0.00 0.69 0.00 0.00 54.13 54.73 1b9n s LEU 150 Cb -0.11 -2.00 0.22 0.00 -0.43 0.00 0.00 46.19 43.87 1b9n s LEU 150 CO 0.02 0.15 1.14 -0.76 -0.29 0.00 0.00 176.35 176.61 1b9n s LEU 151 N 0.54 1.45 0.13 -0.68 2.01 0.24 -0.93 118.68 121.45 1b9n s LEU 151 Ca 0.05 0.78 0.09 0.00 0.01 0.00 0.00 54.13 55.06 1b9n s LEU 151 Cb -0.12 -2.79 -0.16 0.00 0.01 0.00 0.00 46.19 43.13 1b9n s LEU 151 CO 0.01 -3.37 1.23 0.00 1.01 0.00 0.00 176.35 175.23 1b9n h ALA 152 N -2.07 0.47 0.00 4.21 0.00 -1.84 -2.92 119.26 117.11 1b9n h ALA 152 Ca -0.49 -0.87 0.00 0.00 0.00 0.00 0.00 54.91 53.55 1b9n h ALA 152 Cb 1.30 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1b9n h ALA 152 CO 0.47 1.15 0.00 -3.47 0.00 0.00 0.00 179.25 177.39 1b9n n ASP 153 N -3.28 0.19 0.00 0.00 -0.08 -1.26 -4.87 116.55 107.25 1b9n n ASP 153 Ca -0.02 -1.61 0.00 0.00 -1.51 0.00 0.00 54.79 51.65 1b9n n ASP 153 Cb 0.91 -0.10 0.00 0.00 2.34 0.00 0.00 41.12 44.27 1b9n n ASP 153 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1b9n n GLY 154 N 0.26 2.85 0.54 0.27 0.00 -1.10 -4.86 105.19 103.14 1b9n n GLY 154 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 1b9n n GLY 154 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1b9n n LYS 155 N -2.00 0.23 -1.70 1.61 2.85 -1.26 -4.89 118.16 113.00 1b9n n LYS 155 Ca 0.00 0.09 -0.53 0.00 -1.05 0.00 0.00 58.31 56.82 1b9n n LYS 155 Cb 0.00 -0.94 -0.06 0.00 -0.65 0.00 0.00 35.03 33.38 1b9n n LYS 155 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 1b9n n THR 156 N -3.32 0.43 -4.16 0.58 -1.04 -1.26 -4.83 114.28 100.68 1b9n n THR 156 Ca -0.20 -0.08 -0.32 0.00 -2.04 0.00 0.00 64.05 61.41 1b9n n THR 156 Cb 0.65 -1.53 -0.08 0.00 -1.82 0.00 0.00 70.33 67.56 1b9n n THR 156 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1b9n s ARG 157 N 3.74 2.87 0.22 -2.82 0.52 -1.26 -0.59 118.95 121.63 1b9n s ARG 157 Ca 0.95 -0.61 0.09 0.00 -0.52 0.00 0.00 55.73 55.64 1b9n s ARG 157 Cb -0.89 -2.73 -0.05 0.00 0.52 0.00 0.00 34.95 31.81 1b9n s ARG 157 CO 0.59 0.61 -0.16 -0.51 0.02 0.00 0.00 175.30 175.85 1b9n s LEU 158 N -1.88 2.56 -0.10 2.53 1.43 0.17 -4.91 118.68 118.47 1b9n s LEU 158 Ca 0.23 -1.01 0.00 0.00 -1.03 0.00 0.00 54.13 52.33 1b9n s LEU 158 Cb -0.12 -0.79 -0.02 0.00 0.03 0.00 0.00 46.19 45.29 1b9n s LEU 158 CO 0.15 -0.11 -0.09 -0.75 0.23 0.00 0.00 176.35 175.78 1b9n s LYS 159 N -3.54 3.05 -0.15 1.70 2.20 -1.26 -0.65 119.74 121.09 1b9n s LYS 159 Ca 0.24 -0.61 -0.00 0.00 -0.36 0.00 0.00 55.97 55.24 1b9n s LYS 159 Cb -0.02 -2.62 0.03 0.00 -1.51 0.00 0.00 37.83 33.71 1b9n s LYS 159 CO 0.09 0.45 -0.09 0.08 -0.36 0.00 0.00 175.35 175.52 1b9n s VAL 160 N -0.25 1.25 0.18 4.02 1.01 -0.40 -4.53 120.40 121.67 1b9n s VAL 160 Ca 0.03 -0.55 -0.30 0.00 0.00 0.00 0.00 61.98 61.15 1b9n s VAL 160 Cb -0.13 -1.30 -0.08 0.00 0.00 0.00 0.00 36.38 34.87 1b9n s VAL 160 CO 0.03 0.30 1.27 0.00 0.00 0.00 0.00 175.10 176.70 1b9n s ALA 161 N 1.60 3.49 -0.29 5.51 0.00 -0.21 -1.47 121.76 130.38 1b9n s ALA 161 Ca 0.03 1.04 -0.22 0.00 0.00 0.00 0.00 51.96 52.82 1b9n s ALA 161 Cb -0.14 -3.46 0.15 0.00 0.00 0.00 0.00 23.12 19.67 1b9n s ALA 161 CO -0.09 -0.48 1.12 -1.50 0.00 0.00 0.00 175.76 174.81 1b9n s ILE 162 N 0.20 0.00 0.96 0.00 2.07 -0.89 -4.79 121.20 118.76 1b9n s ILE 162 Ca 0.56 0.00 -0.11 0.00 -1.41 0.00 0.00 60.65 59.69 1b9n s ILE 162 Cb -0.35 -1.00 0.17 0.00 0.13 0.00 0.00 42.46 41.41 1b9n s ILE 162 CO 0.36 0.00 1.10 0.42 -1.91 0.00 0.00 174.94 174.92 1b9n s THR 163 N 0.59 2.27 0.33 4.00 -4.23 -1.26 -3.53 115.64 113.81 1b9n s THR 163 Ca -0.01 0.09 0.02 0.00 -1.18 0.00 0.00 61.69 60.61 1b9n s THR 163 Cb -0.04 -2.23 0.28 0.00 1.34 0.00 0.00 72.50 71.85 1b9n s THR 163 CO -0.11 -0.11 1.96 0.00 -0.54 0.00 0.00 174.62 175.81 1b9n h ALA 164 N -1.94 1.56 -0.01 3.99 0.00 -1.96 -1.37 119.26 119.52 1b9n h ALA 164 Ca -0.49 -0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.21 1b9n h ALA 164 Cb 1.28 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 1b9n h ALA 164 CO 0.46 0.35 -0.79 -0.56 0.00 0.00 0.00 179.25 178.72 1b9n h GLN 165 N 0.93 0.16 0.06 0.00 -0.00 -1.99 0.17 115.11 114.45 1b9n h GLN 165 Ca 0.32 -0.16 -0.25 0.00 -0.00 0.00 0.00 58.65 58.56 1b9n h GLN 165 Cb 0.10 0.04 0.00 0.00 -0.00 0.00 0.00 27.48 27.62 1b9n h GLN 165 CO -0.10 0.87 -1.08 0.77 -0.00 0.00 0.00 178.83 179.29 1b9n h SER 166 N 0.10 0.50 -0.94 0.06 0.02 -1.84 -0.51 113.55 110.94 1b9n h SER 166 Ca -0.03 -0.45 0.12 0.00 -0.84 0.00 0.00 61.79 60.59 1b9n h SER 166 Cb 1.38 -0.16 -0.08 0.00 0.14 0.00 0.00 62.40 63.68 1b9n h SER 166 CO 0.12 1.29 0.57 1.23 -1.14 0.00 0.00 176.83 178.89 1b9n h GLY 167 N 1.34 1.52 0.97 -3.77 0.00 -1.12 0.03 103.07 102.05 1b9n h GLY 167 Ca -0.11 -0.37 -0.11 0.00 0.00 0.00 0.00 47.33 46.74 1b9n h GLY 167 CO 0.18 0.12 -0.20 0.00 0.00 0.00 0.00 176.54 176.64 1b9n h ALA 168 N 1.52 0.48 0.00 3.60 0.00 -0.40 0.00 119.26 124.47 1b9n h ALA 168 Ca 0.47 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1b9n h ALA 168 Cb 0.49 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1b9n h ALA 168 CO -0.28 0.43 -0.20 -0.09 0.00 0.00 0.00 179.25 179.11 1b9n h ARG 169 N 0.50 0.00 0.00 0.00 2.43 -0.70 -1.19 114.38 115.42 1b9n h ARG 169 Ca 0.07 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 1b9n h ARG 169 Cb 0.75 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.30 1b9n h ARG 169 CO 0.06 0.20 -0.47 1.28 -1.51 0.00 0.00 179.97 179.53 1b9n n LEU 170 N -3.67 0.50 -0.47 3.80 4.77 -0.04 -4.95 117.00 116.95 1b9n n LEU 170 Ca -0.01 0.14 -0.01 0.00 -0.03 0.00 0.00 56.01 56.10 1b9n n LEU 170 Cb 0.32 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 1b9n n LEU 170 CO 0.33 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 1b9n n GLY 171 N 1.45 0.73 3.50 -0.72 0.00 -0.43 -4.78 105.19 104.93 1b9n n GLY 171 Ca 0.05 -0.70 -0.35 0.00 0.00 0.00 0.00 46.02 45.02 1b9n n GLY 171 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1b9n n LEU 172 N -0.52 3.88 -4.87 0.99 4.77 -0.14 -4.81 117.00 116.29 1b9n n LEU 172 Ca -0.00 -3.41 -0.25 0.00 -0.03 0.00 0.00 56.01 52.32 1b9n n LEU 172 Cb 0.50 -1.68 -0.04 0.00 -2.33 0.00 0.00 43.42 39.87 1b9n n LEU 172 CO 0.02 -0.98 -0.14 -1.81 -1.33 0.00 0.00 177.39 173.15 1b9n s ASP 173 N 5.53 5.90 -0.22 -1.43 1.01 -1.26 -4.95 116.67 121.24 1b9n s ASP 173 Ca 0.62 -0.03 -0.43 0.00 0.71 0.00 0.00 52.55 53.43 1b9n s ASP 173 Cb 0.03 -1.65 -0.20 0.00 1.01 0.00 0.00 42.92 42.12 1b9n s ASP 173 CO 0.11 0.02 1.34 1.21 0.21 0.00 0.00 175.17 178.06 1b9n n GLU 174 N -0.72 0.10 0.00 8.23 2.13 -1.26 0.62 120.64 129.74 1b9n n GLU 174 Ca -0.08 0.04 0.00 0.00 0.66 0.00 0.00 57.16 57.78 1b9n n GLU 174 Cb 0.55 -1.55 0.00 0.00 0.27 0.00 0.00 31.44 30.71 1b9n n GLU 174 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1b9n n GLY 175 N 2.74 2.90 3.68 8.31 0.00 0.21 -4.95 105.19 118.08 1b9n n GLY 175 Ca 0.25 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.81 1b9n n GLY 175 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1b9n n LYS 176 N -2.00 2.28 -1.78 1.61 4.81 0.20 -4.59 118.16 118.69 1b9n n LYS 176 Ca 0.00 0.83 -0.41 0.00 -0.87 0.00 0.00 58.31 57.85 1b9n n LYS 176 Cb 0.00 -2.64 -0.02 0.00 0.02 0.00 0.00 35.03 32.39 1b9n n LYS 176 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 1b9n s GLU 177 N 2.21 4.12 0.12 1.64 2.12 -1.26 -2.11 118.70 125.55 1b9n s GLU 177 Ca 0.84 2.58 0.05 0.00 0.36 0.00 0.00 54.97 58.80 1b9n s GLU 177 Cb -0.65 -3.02 -0.04 0.00 0.26 0.00 0.00 34.13 30.68 1b9n s GLU 177 CO 0.42 -0.63 -0.13 0.14 -0.54 0.00 0.00 175.26 174.52 1b9n s VAL 178 N -0.01 1.24 -0.17 3.70 -7.23 0.17 -4.78 120.40 113.32 1b9n s VAL 178 Ca 0.63 -1.75 -0.07 0.00 -1.81 0.00 0.00 61.98 58.99 1b9n s VAL 178 Cb -0.48 -1.54 -0.04 0.00 0.56 0.00 0.00 36.38 34.88 1b9n s VAL 178 CO 0.48 -0.49 0.05 -0.22 -0.31 0.00 0.00 175.10 174.61 1b9n s LEU 179 N -2.55 3.76 -0.16 1.32 2.96 0.13 -1.40 118.68 122.75 1b9n s LEU 179 Ca 0.09 0.08 -0.01 0.00 -0.22 0.00 0.00 54.13 54.07 1b9n s LEU 179 Cb -0.04 -1.94 -0.01 0.00 0.50 0.00 0.00 46.19 44.70 1b9n s LEU 179 CO 0.02 0.20 -0.11 -0.51 -1.32 0.00 0.00 176.35 174.63 1b9n s ILE 180 N 0.22 3.08 -0.10 6.68 1.10 0.98 -0.45 121.20 132.71 1b9n s ILE 180 Ca 0.03 -0.63 0.03 0.00 -0.51 0.00 0.00 60.65 59.58 1b9n s ILE 180 Cb -0.12 -2.33 -0.00 0.00 0.15 0.00 0.00 42.46 40.15 1b9n s ILE 180 CO 0.01 0.50 -0.22 -0.76 -2.11 0.00 0.00 174.94 172.36 1b9n s LEU 181 N 0.74 2.23 -0.27 8.50 1.43 -0.41 -1.32 118.68 129.58 1b9n s LEU 181 Ca -0.05 -0.51 -0.01 0.00 -1.03 0.00 0.00 54.13 52.53 1b9n s LEU 181 Cb -0.15 -1.45 0.15 0.00 0.03 0.00 0.00 46.19 44.77 1b9n s LEU 181 CO 0.02 0.17 0.44 -0.22 0.23 0.00 0.00 176.35 176.98 1b9n s LEU 182 N 0.32 -0.88 0.44 1.79 2.96 -0.57 -1.50 118.68 121.24 1b9n s LEU 182 Ca -0.17 0.25 -0.26 0.00 -0.22 0.00 0.00 54.13 53.74 1b9n s LEU 182 Cb -0.17 1.39 -0.09 0.00 0.50 0.00 0.00 46.19 47.82 1b9n s LEU 182 CO 0.08 -0.30 1.43 0.29 -1.32 0.00 0.00 176.35 176.53 1b9n n LYS 183 N 5.38 2.29 -0.32 1.98 5.02 -1.26 -2.65 118.16 128.60 1b9n n LYS 183 Ca -0.02 0.82 0.16 0.00 -2.02 0.00 0.00 58.31 57.24 1b9n n LYS 183 Cb 0.50 -2.62 0.35 0.00 -0.02 0.00 0.00 35.03 33.24 1b9n n LYS 183 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1b9n h ALA 184 N 2.37 1.59 -0.04 7.82 0.00 -1.95 -1.73 119.26 127.32 1b9n h ALA 184 Ca -0.51 0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1b9n h ALA 184 Cb 1.27 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.18 1b9n h ALA 184 CO 0.61 -0.36 0.00 -0.35 0.00 0.00 0.00 179.25 179.16 1b9n n PRO 185 N -5.01 1.17 0.00 0.00 -0.05 -1.26 -1.87 135.00 127.98 1b9n n PRO 185 Ca 0.25 -0.26 0.12 0.00 -0.05 0.00 0.00 63.50 63.56 1b9n n PRO 185 Cb 0.72 -1.33 0.12 0.00 -0.05 0.00 0.00 33.50 32.95 1b9n n PRO 185 CO 0.00 0.00 0.00 0.91 -0.05 0.00 0.00 175.50 176.36 1b9n n TRP 186 N -0.54 0.00 -3.92 0.54 8.01 -0.65 -4.87 117.44 116.00 1b9n n TRP 186 Ca 0.15 0.00 -0.35 0.00 -1.31 0.00 0.00 57.50 55.99 1b9n n TRP 186 Cb 0.13 -0.00 -0.10 0.00 -2.01 0.00 0.00 31.31 29.33 1b9n n TRP 186 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.69 176.76 1b9n s VAL 187 N -2.14 4.92 0.20 -0.99 1.01 -0.78 -4.70 120.40 117.92 1b9n s VAL 187 Ca 0.26 0.01 -0.09 0.00 0.00 0.00 0.00 61.98 62.17 1b9n s VAL 187 Cb 0.20 -3.23 -0.07 0.00 0.00 0.00 0.00 36.38 33.28 1b9n s VAL 187 CO 0.38 0.44 0.51 -0.83 0.00 0.00 0.00 175.10 175.60 1b9n s GLY 188 N 0.48 2.29 -0.14 4.51 0.00 0.22 -4.33 107.32 110.36 1b9n s GLY 188 Ca 0.04 -0.32 0.01 0.00 0.00 0.00 0.00 44.72 44.45 1b9n s GLY 188 CO 0.00 -0.18 -0.14 -0.42 0.00 0.00 0.00 173.10 172.36 1b9n s ILE 189 N -1.74 1.55 0.03 0.90 -1.09 -1.26 -0.75 121.20 118.83 1b9n s ILE 189 Ca 0.45 -0.63 0.01 0.00 -2.23 0.00 0.00 60.65 58.25 1b9n s ILE 189 Cb -0.12 -1.44 -0.02 0.00 -1.58 0.00 0.00 42.46 39.30 1b9n s ILE 189 CO 0.21 0.45 -0.06 0.28 -1.23 0.00 0.00 174.94 174.60 1b9n s THR 190 N 1.33 0.36 -2.46 2.92 -1.32 0.23 -4.97 115.64 111.74 1b9n s THR 190 Ca 0.01 -0.89 0.21 0.00 -1.21 0.00 0.00 61.69 59.81 1b9n s THR 190 Cb -0.13 -0.44 0.27 0.00 -1.51 0.00 0.00 72.50 70.68 1b9n s THR 190 CO -0.08 -0.36 1.25 0.00 -2.21 0.00 0.00 174.62 173.23 1b9n n GLN 191 N 1.72 2.15 -3.70 7.08 10.64 -1.26 -0.72 117.38 133.29 1b9n n GLN 191 Ca -0.22 -1.96 -0.38 0.00 -1.83 0.00 0.00 57.00 52.61 1b9n n GLN 191 Cb 0.55 -1.43 -0.12 0.00 -0.86 0.00 0.00 30.24 28.38 1b9n n GLN 191 CO 0.00 0.00 0.00 0.34 -1.83 0.00 0.00 177.06 175.57 1b9n s ASP 192 N -1.59 5.40 0.55 2.61 -1.08 -1.26 -4.97 116.67 116.33 1b9n s ASP 192 Ca 0.29 -0.87 0.22 0.00 -0.52 0.00 0.00 52.55 51.68 1b9n s ASP 192 Cb 0.19 -1.93 1.49 0.00 -1.46 0.00 0.00 42.92 41.21 1b9n s ASP 192 CO 0.27 -0.28 2.16 -0.33 0.52 0.00 0.00 175.17 177.51 1b9n h GLU 193 N 8.30 0.00 -0.14 4.34 4.39 -1.99 0.25 114.58 129.74 1b9n h GLU 193 Ca -0.28 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.31 1b9n h GLU 193 Cb 1.11 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.75 1b9n h GLU 193 CO 0.62 0.00 -0.41 0.00 -1.16 0.00 0.00 179.01 178.06 1b9n h ALA 194 N 1.94 1.05 -0.07 3.43 0.00 -1.99 0.52 119.26 124.13 1b9n h ALA 194 Ca 0.04 -0.42 -0.08 0.00 0.00 0.00 0.00 54.91 54.45 1b9n h ALA 194 Cb 0.17 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1b9n h ALA 194 CO -0.00 0.60 -0.26 0.28 0.00 0.00 0.00 179.25 179.88 1b9n h VAL 195 N 0.26 1.42 -0.92 0.00 2.07 -0.96 -3.28 116.25 114.84 1b9n h VAL 195 Ca 0.02 -1.64 -0.01 0.00 0.82 0.00 0.00 66.70 65.90 1b9n h VAL 195 Cb 0.84 2.28 -0.04 0.00 -1.52 0.00 0.00 31.29 32.85 1b9n h VAL 195 CO 0.07 0.47 0.55 0.00 0.02 0.00 0.00 177.57 178.68 1b9n h ALA 196 N 0.45 1.18 0.00 1.67 0.00 -1.15 -2.76 119.26 118.64 1b9n h ALA 196 Ca -0.01 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1b9n h ALA 196 Cb 0.89 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 1b9n h ALA 196 CO 0.05 0.64 -0.00 0.37 0.00 0.00 0.00 179.25 180.31 1b9n h GLN 197 N 1.28 0.00 -0.10 0.00 4.15 -0.94 0.62 115.11 120.11 1b9n h GLN 197 Ca 0.33 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.75 1b9n h GLN 197 Cb -0.05 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.64 1b9n h GLN 197 CO -0.06 0.00 0.00 0.09 -1.93 0.00 0.00 178.83 176.93 1b9n n ASN 198 N -3.10 2.20 -4.86 -0.69 3.02 -1.04 -4.94 115.26 105.84 1b9n n ASN 198 Ca -0.02 -1.74 -0.31 0.00 -0.03 0.00 0.00 54.58 52.48 1b9n n ASN 198 Cb 0.16 -0.05 -0.01 0.00 -0.61 0.00 0.00 39.78 39.26 1b9n n ASN 198 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1b9n s ALA 199 N -1.89 3.15 0.09 5.41 0.00 0.21 -5.00 121.76 123.73 1b9n s ALA 199 Ca 0.34 -0.05 -0.20 0.00 0.00 0.00 0.00 51.96 52.05 1b9n s ALA 199 Cb 0.20 -2.99 -0.08 0.00 0.00 0.00 0.00 23.12 20.25 1b9n s ALA 199 CO 0.31 -0.40 1.60 -0.44 0.00 0.00 0.00 175.76 176.83 1b9n h ASP 200 N 0.38 0.31 -4.29 0.00 3.32 -1.87 -3.43 116.42 110.85 1b9n h ASP 200 Ca -0.46 -0.20 -0.58 0.00 0.02 0.00 0.00 57.03 55.81 1b9n h ASP 200 Cb 1.19 -0.08 -0.30 0.00 0.22 0.00 0.00 39.33 40.36 1b9n h ASP 200 CO 0.62 0.43 -0.85 0.20 -1.72 0.00 0.00 179.24 177.93 1b9n s ASN 201 N -5.69 2.27 -0.06 6.45 0.01 -0.56 -4.76 114.94 112.59 1b9n s ASN 201 Ca -0.14 -0.35 -0.00 0.00 -0.71 0.00 0.00 52.86 51.66 1b9n s ASN 201 Cb 0.07 -0.33 0.02 0.00 0.41 0.00 0.00 41.25 41.43 1b9n s ASN 201 CO 0.72 0.22 -0.03 -1.10 -1.51 0.00 0.00 177.10 175.40 1b9n s GLN 202 N -0.36 0.83 -0.34 -0.60 -0.21 -1.26 -2.26 119.66 115.47 1b9n s GLN 202 Ca 0.05 -0.04 0.01 0.00 0.02 0.00 0.00 55.36 55.40 1b9n s GLN 202 Cb -0.08 -0.98 0.10 0.00 1.00 0.00 0.00 33.01 33.05 1b9n s GLN 202 CO -0.00 -0.19 0.10 -0.51 -2.12 0.00 0.00 175.29 172.57 1b9n s LEU 203 N 1.41 3.17 0.64 2.90 1.43 0.58 -4.96 118.68 123.84 1b9n s LEU 203 Ca -0.03 -1.93 -0.17 0.00 -1.03 0.00 0.00 54.13 50.97 1b9n s LEU 203 Cb -0.13 -1.15 -0.01 0.00 0.03 0.00 0.00 46.19 44.92 1b9n s LEU 203 CO -0.03 -0.39 1.18 -2.16 0.23 0.00 0.00 176.35 175.19 1b9n s PRO 204 N 1.23 2.75 0.04 1.29 0.04 -1.26 -1.52 135.00 137.57 1b9n s PRO 204 Ca 0.11 1.71 -0.27 0.00 0.04 0.00 0.00 61.00 62.59 1b9n s PRO 204 Cb -0.19 -1.91 0.09 0.00 0.04 0.00 0.00 34.50 32.53 1b9n s PRO 204 CO -0.17 -1.35 1.21 0.20 0.04 0.00 0.00 177.00 176.93 1b9n s GLY 205 N -1.91 -0.12 -0.15 0.56 0.00 -0.51 -4.43 107.32 100.76 1b9n s GLY 205 Ca 0.74 0.05 -0.05 0.00 0.00 0.00 0.00 44.72 45.47 1b9n s GLY 205 CO 0.37 3.65 0.01 -0.42 0.00 0.00 0.00 173.10 176.71 1b9n s ILE 206 N -2.17 4.31 0.08 0.90 1.01 -1.02 -0.50 121.20 123.80 1b9n s ILE 206 Ca 0.24 -0.22 -0.31 0.00 0.00 0.00 0.00 60.65 60.37 1b9n s ILE 206 Cb -0.00 -2.89 -0.08 0.00 0.01 0.00 0.00 42.46 39.49 1b9n s ILE 206 CO 0.00 0.51 1.64 -0.63 0.00 0.00 0.00 174.94 176.46 1b9n s ILE 207 N 0.11 3.01 -0.30 2.92 1.01 0.42 -0.49 121.20 127.87 1b9n s ILE 207 Ca 0.02 0.49 0.07 0.00 0.00 0.00 0.00 60.65 61.23 1b9n s ILE 207 Cb -0.13 -3.32 -0.08 0.00 0.01 0.00 0.00 42.46 38.94 1b9n s ILE 207 CO 0.02 0.00 0.29 -1.54 0.00 0.00 0.00 174.94 173.71 1b9n n SER 208 N 5.43 0.72 -3.64 3.58 3.41 0.04 -0.49 113.62 122.67 1b9n n SER 208 Ca 0.16 -0.59 -0.07 0.00 -0.26 0.00 0.00 58.87 58.11 1b9n n SER 208 Cb 0.40 1.04 -0.07 0.00 -0.26 0.00 0.00 64.21 65.33 1b9n n SER 208 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1b9n s HIS 209 N -1.79 -0.52 -0.02 7.33 5.65 -1.11 -4.91 115.29 119.92 1b9n s HIS 209 Ca 0.02 1.18 0.03 0.00 0.25 0.00 0.00 55.06 56.54 1b9n s HIS 209 Cb 0.05 0.37 0.00 0.00 -1.18 0.00 0.00 32.58 31.82 1b9n s HIS 209 CO 0.30 -0.25 -0.10 0.42 -0.65 0.00 0.00 174.74 174.46 1b9n s ILE 210 N 0.57 0.85 -0.24 0.89 1.01 -1.26 -1.15 121.20 121.87 1b9n s ILE 210 Ca -0.00 -0.41 -0.01 0.00 0.00 0.00 0.00 60.65 60.23 1b9n s ILE 210 Cb -0.05 -0.74 0.07 0.00 0.01 0.00 0.00 42.46 41.75 1b9n s ILE 210 CO -0.09 0.26 0.02 -0.70 0.00 0.00 0.00 174.94 174.42 1b9n s GLU 211 N 0.08 1.05 -0.22 2.79 2.56 -0.62 -4.98 118.70 119.37 1b9n s GLU 211 Ca -0.01 -0.83 -0.15 0.00 0.00 0.00 0.00 54.97 53.98 1b9n s GLU 211 Cb -0.08 -2.30 -0.04 0.00 2.00 0.00 0.00 34.13 33.71 1b9n s GLU 211 CO 0.00 -0.71 0.36 1.03 -0.56 0.00 0.00 175.26 175.38 1b9n s ARG 212 N 1.60 4.14 0.01 4.30 0.52 -1.26 -1.42 118.95 126.84 1b9n s ARG 212 Ca -0.00 0.11 0.00 0.00 -0.52 0.00 0.00 55.73 55.32 1b9n s ARG 212 Cb -0.18 -3.55 0.00 0.00 0.52 0.00 0.00 34.95 31.74 1b9n s ARG 212 CO -0.11 -0.05 0.01 0.41 0.02 0.00 0.00 175.30 175.58 1b9n n GLY 213 N 4.06 3.03 0.20 -3.53 0.00 0.51 -5.01 105.19 104.46 1b9n n GLY 213 Ca -0.09 -2.17 0.08 0.00 0.00 0.00 0.00 46.02 43.84 1b9n n GLY 213 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b9n h ALA 214 N 0.74 0.90 0.00 4.61 0.00 -2.03 -3.36 119.26 120.12 1b9n h ALA 214 Ca -0.01 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1b9n h ALA 214 Cb 0.02 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1b9n h ALA 214 CO 0.01 0.31 -0.80 -0.85 0.00 0.00 0.00 179.25 177.92 1b9n n GLU 215 N -3.25 2.42 -4.39 0.00 0.00 -1.26 -4.92 120.64 109.25 1b9n n GLU 215 Ca 0.02 0.00 -0.21 0.00 0.00 0.00 0.00 57.16 56.97 1b9n n GLU 215 Cb 0.54 -0.90 -0.10 0.00 0.00 0.00 0.00 31.44 30.98 1b9n n GLU 215 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.13 176.48 1b9n s GLN 216 N -1.73 1.44 -0.06 3.44 -1.52 -1.26 -1.38 119.66 118.60 1b9n s GLN 216 Ca 0.00 -1.63 -0.00 0.00 -1.95 0.00 0.00 55.36 51.77 1b9n s GLN 216 Cb 0.00 -1.37 0.03 0.00 -0.22 0.00 0.00 33.01 31.44 1b9n s GLN 216 CO 0.00 0.25 -0.02 0.00 -0.25 0.00 0.00 175.29 175.27 1b9n s GLU 218 N 1.58 4.37 -0.15 0.00 0.41 -0.51 -0.95 118.70 123.45 1b9n s GLU 218 Ca -0.01 0.88 -0.05 0.00 -0.41 0.00 0.00 54.97 55.39 1b9n s GLU 218 Cb -0.13 -3.50 -0.03 0.00 -1.78 0.00 0.00 34.13 28.69 1b9n s GLU 218 CO -0.04 -0.08 0.00 0.08 -0.49 0.00 0.00 175.26 174.74 1b9n s VAL 219 N 1.30 4.25 -0.08 2.63 1.01 0.11 -1.59 120.40 128.03 1b9n s VAL 219 Ca 0.37 -0.23 0.01 0.00 0.00 0.00 0.00 61.98 62.13 1b9n s VAL 219 Cb -0.17 -2.87 -0.02 0.00 0.00 0.00 0.00 36.38 33.31 1b9n s VAL 219 CO 0.16 0.50 -0.11 -0.76 0.00 0.00 0.00 175.10 174.89 1b9n s LEU 220 N 0.18 2.90 -0.04 3.92 1.43 -0.30 -1.31 118.68 125.46 1b9n s LEU 220 Ca 0.01 -0.17 0.05 0.00 -1.03 0.00 0.00 54.13 52.99 1b9n s LEU 220 Cb -0.13 -1.62 -0.01 0.00 0.03 0.00 0.00 46.19 44.46 1b9n s LEU 220 CO 0.02 0.30 -0.19 -0.32 0.23 0.00 0.00 176.35 176.39 1b9n s MET 221 N -0.44 1.86 -0.48 1.70 -2.45 0.11 -0.78 119.30 118.82 1b9n s MET 221 Ca 0.06 -0.67 -0.27 0.00 -1.25 0.00 0.00 55.69 53.56 1b9n s MET 221 Cb -0.12 -1.64 0.03 0.00 1.25 0.00 0.00 34.83 34.35 1b9n s MET 221 CO 0.02 0.29 1.05 0.00 1.05 0.00 0.00 175.02 177.44 1b9n s ALA 222 N -0.08 3.18 0.47 4.11 0.00 0.35 -0.32 121.76 129.47 1b9n s ALA 222 Ca -0.02 -0.64 -0.22 0.00 0.00 0.00 0.00 51.96 51.09 1b9n s ALA 222 Cb -0.11 -3.80 -0.08 0.00 0.00 0.00 0.00 23.12 19.13 1b9n s ALA 222 CO 0.02 -2.21 1.10 -0.51 0.00 0.00 0.00 175.76 174.16 1b9n s LEU 223 N 4.20 3.95 0.45 0.00 1.43 -0.69 -2.44 118.68 125.58 1b9n s LEU 223 Ca 0.43 2.13 0.31 0.00 -1.03 0.00 0.00 54.13 55.97 1b9n s LEU 223 Cb -0.08 -4.37 1.42 0.00 0.03 0.00 0.00 46.19 43.18 1b9n s LEU 223 CO 0.29 -0.86 1.66 -0.65 0.23 0.00 0.00 176.35 177.02 1b9n h PRO 224 N 1.86 0.11 -0.93 1.29 0.11 -1.90 -1.34 132.00 131.20 1b9n h PRO 224 Ca -0.49 -0.01 -0.48 0.00 0.11 0.00 0.00 66.00 65.14 1b9n h PRO 224 Cb 1.24 -0.03 -0.28 0.00 0.11 0.00 0.00 31.00 32.04 1b9n h PRO 224 CO 0.60 0.07 0.58 -0.25 -0.21 0.00 0.00 178.00 178.79 1b9n n ASP 225 N -4.56 3.70 0.00 -2.05 8.00 -1.26 -5.01 116.55 115.37 1b9n n ASP 225 Ca 0.35 -3.61 0.00 0.00 0.71 0.00 0.00 54.79 52.25 1b9n n ASP 225 Cb 1.39 -0.82 0.00 0.00 -0.02 0.00 0.00 41.12 41.68 1b9n n ASP 225 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1b9n n GLY 226 N -1.10 3.11 3.75 0.44 0.00 -0.50 -4.89 105.19 105.99 1b9n n GLY 226 Ca 0.57 -0.84 -0.29 0.00 0.00 0.00 0.00 46.02 45.46 1b9n n GLY 226 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1b9n s GLN 227 N 0.00 0.99 -0.17 1.61 -0.21 -1.26 -4.78 119.66 115.84 1b9n s GLN 227 Ca 0.00 0.43 -0.01 0.00 0.02 0.00 0.00 55.36 55.80 1b9n s GLN 227 Cb 0.00 -1.81 -0.01 0.00 1.00 0.00 0.00 33.01 32.19 1b9n s GLN 227 CO 0.00 -2.33 -0.10 -0.08 -2.12 0.00 0.00 175.29 170.66 1b9n s THR 228 N -3.14 3.08 0.09 -0.19 -1.32 -1.26 -1.71 115.64 111.19 1b9n s THR 228 Ca 0.64 -0.62 -0.18 0.00 -1.21 0.00 0.00 61.69 60.32 1b9n s THR 228 Cb -0.16 -2.34 -0.07 0.00 -1.51 0.00 0.00 72.50 68.43 1b9n s THR 228 CO 0.55 0.49 0.55 -0.22 -2.21 0.00 0.00 174.62 173.78 1b9n s LEU 229 N 0.87 4.47 -0.13 9.08 0.20 0.56 -4.88 118.68 128.84 1b9n s LEU 229 Ca -0.03 1.19 -0.00 0.00 0.69 0.00 0.00 54.13 55.98 1b9n s LEU 229 Cb -0.15 -2.99 -0.01 0.00 -0.43 0.00 0.00 46.19 42.61 1b9n s LEU 229 CO 0.00 0.23 -0.13 0.00 -0.29 0.00 0.00 176.35 176.16 1b9n s ALA 231 N 0.43 1.52 -0.22 0.00 0.00 -0.43 -4.28 121.76 118.78 1b9n s ALA 231 Ca -0.10 -1.16 -0.01 0.00 0.00 0.00 0.00 51.96 50.69 1b9n s ALA 231 Cb -0.16 -0.16 0.06 0.00 0.00 0.00 0.00 23.12 22.86 1b9n s ALA 231 CO 0.05 0.25 -0.02 0.99 0.00 0.00 0.00 175.76 177.03 1b9n s THR 232 N -1.35 1.16 0.19 0.00 2.01 -0.79 0.04 115.64 116.90 1b9n s THR 232 Ca 0.04 -0.98 0.11 0.00 0.31 0.00 0.00 61.69 61.17 1b9n s THR 232 Cb -0.09 -1.52 -0.04 0.00 0.01 0.00 0.00 72.50 70.86 1b9n s THR 232 CO 0.03 -0.15 -0.24 -0.69 -0.69 0.00 0.00 174.62 172.89 1b9n s VAL 233 N 1.57 2.38 0.17 3.82 1.01 -0.13 -4.24 120.40 124.98 1b9n s VAL 233 Ca -0.04 -2.02 -0.33 0.00 0.00 0.00 0.00 61.98 59.59 1b9n s VAL 233 Cb -0.18 -2.14 -0.15 0.00 0.00 0.00 0.00 36.38 33.91 1b9n s VAL 233 CO -0.07 -0.11 1.32 -2.65 0.00 0.00 0.00 175.10 173.59 1b9n n PRO 234 N 0.27 1.54 -0.35 2.72 -0.02 -1.26 -0.36 135.00 137.54 1b9n n PRO 234 Ca -0.13 0.55 0.05 0.00 -2.02 0.00 0.00 63.50 61.96 1b9n n PRO 234 Cb 0.56 -2.16 0.23 0.00 -0.02 0.00 0.00 33.50 32.10 1b9n n PRO 234 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1b9n h VAL 235 N 3.04 0.99 0.00 -1.45 2.07 -1.49 -1.83 116.25 117.58 1b9n h VAL 235 Ca -0.45 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 66.71 1b9n h VAL 235 Cb 1.31 -0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 1b9n h VAL 235 CO 0.76 0.19 0.00 0.59 0.02 0.00 0.00 177.57 179.13 1b9n n ASN 236 N -4.56 0.54 -0.56 0.57 5.03 -1.26 -0.83 115.26 114.19 1b9n n ASN 236 Ca 0.17 0.66 0.13 0.00 0.87 0.00 0.00 54.58 56.41 1b9n n ASN 236 Cb 0.28 -0.76 0.44 0.00 -1.02 0.00 0.00 39.78 38.72 1b9n n ASN 236 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1b9n n GLU 237 N -2.13 1.76 -0.01 3.52 1.02 -0.69 -4.00 120.64 120.11 1b9n n GLU 237 Ca 0.02 -1.11 0.01 0.00 -0.02 0.00 0.00 57.16 56.05 1b9n n GLU 237 Cb 0.18 -1.45 0.01 0.00 -0.02 0.00 0.00 31.44 30.15 1b9n n GLU 237 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1b9n n ALA 238 N 0.34 2.19 -0.25 0.62 0.00 -0.01 -4.77 120.51 118.62 1b9n n ALA 238 Ca 0.18 -0.84 -0.04 0.00 0.00 0.00 0.00 53.44 52.74 1b9n n ALA 238 Cb 0.37 -0.04 0.07 0.00 0.00 0.00 0.00 19.45 19.85 1b9n n ALA 238 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1b9n h THR 239 N 0.21 1.11 -0.00 0.00 1.35 -1.68 -2.48 112.91 111.42 1b9n h THR 239 Ca 0.00 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.56 1b9n h THR 239 Cb 0.36 0.16 0.00 0.00 -1.73 0.00 0.00 68.15 66.94 1b9n h THR 239 CO 0.00 0.16 -0.32 -1.54 -0.25 0.00 0.00 175.52 173.57 1b9n n SER 240 N -4.65 0.56 -4.77 5.36 3.41 -1.26 -4.93 113.62 107.35 1b9n n SER 240 Ca 0.07 -0.36 -0.39 0.00 -0.26 0.00 0.00 58.87 57.93 1b9n n SER 240 Cb 0.07 0.08 -0.03 0.00 -0.26 0.00 0.00 64.21 64.08 1b9n n SER 240 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1b9n s LEU 241 N -2.80 4.33 0.02 1.04 1.43 -0.94 -5.06 118.68 116.70 1b9n s LEU 241 Ca 0.17 2.35 0.03 0.00 -1.03 0.00 0.00 54.13 55.65 1b9n s LEU 241 Cb 0.18 -3.87 -0.01 0.00 0.03 0.00 0.00 46.19 42.52 1b9n s LEU 241 CO 0.60 -0.48 -0.11 -1.10 0.23 0.00 0.00 176.35 175.49 1b9n s GLN 242 N -1.99 0.77 0.26 1.70 -0.21 -1.26 -5.10 119.66 113.82 1b9n s GLN 242 Ca 0.52 -0.55 -0.31 0.00 0.02 0.00 0.00 55.36 55.05 1b9n s GLN 242 Cb -0.32 -0.72 -0.12 0.00 1.00 0.00 0.00 33.01 32.85 1b9n s GLN 242 CO 0.40 0.18 1.63 0.94 -2.12 0.00 0.00 175.29 176.33 1b9n n GLN 243 N 2.29 2.71 0.00 2.91 7.27 -1.26 -2.29 117.38 129.00 1b9n n GLN 243 Ca -0.17 0.97 0.00 0.00 0.07 0.00 0.00 57.00 57.87 1b9n n GLN 243 Cb 0.56 -2.77 0.00 0.00 2.41 0.00 0.00 30.24 30.44 1b9n n GLN 243 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1b9n n GLY 244 N 2.75 2.44 3.79 1.69 0.00 0.36 -5.00 105.19 111.21 1b9n n GLY 244 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 1b9n n GLY 244 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1b9n s GLN 245 N -0.31 4.49 -0.17 1.61 0.74 -0.97 -4.75 119.66 120.30 1b9n s GLN 245 Ca 0.00 1.23 -0.22 0.00 0.05 0.00 0.00 55.36 56.42 1b9n s GLN 245 Cb 0.00 -2.71 -0.02 0.00 1.10 0.00 0.00 33.01 31.37 1b9n s GLN 245 CO 0.00 0.25 0.70 1.21 -0.55 0.00 0.00 175.29 176.90 1b9n s ASN 246 N -1.71 6.81 0.25 6.67 3.04 -1.26 -0.43 114.94 128.30 1b9n s ASN 246 Ca 0.51 0.98 0.02 0.00 0.04 0.00 0.00 52.86 54.42 1b9n s ASN 246 Cb -0.17 -2.39 -0.01 0.00 -1.54 0.00 0.00 41.25 37.15 1b9n s ASN 246 CO 0.22 -0.29 0.07 1.33 -3.04 0.00 0.00 177.10 175.40 1b9n n VAL 247 N 4.57 0.00 -3.97 -5.21 0.24 0.35 -4.94 118.33 109.36 1b9n n VAL 247 Ca 0.00 -1.39 -0.29 0.00 -2.04 0.00 0.00 64.34 60.63 1b9n n VAL 247 Cb 0.50 0.47 -0.17 0.00 -1.47 0.00 0.00 33.84 33.17 1b9n n VAL 247 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 1b9n s THR 248 N -2.39 1.34 0.14 3.34 -1.32 0.10 -1.42 115.64 115.44 1b9n s THR 248 Ca 0.11 -0.51 -0.27 0.00 -1.21 0.00 0.00 61.69 59.80 1b9n s THR 248 Cb 0.01 -1.31 -0.07 0.00 -1.51 0.00 0.00 72.50 69.61 1b9n s THR 248 CO 0.07 0.40 0.85 0.00 -2.21 0.00 0.00 174.62 173.74 1b9n s ALA 249 N 1.58 3.36 -0.00 11.08 0.00 -0.57 -0.60 121.76 136.60 1b9n s ALA 249 Ca 0.05 0.45 -0.05 0.00 0.00 0.00 0.00 51.96 52.41 1b9n s ALA 249 Cb -0.13 -3.10 -0.00 0.00 0.00 0.00 0.00 23.12 19.89 1b9n s ALA 249 CO -0.10 0.15 0.09 1.52 0.00 0.00 0.00 175.76 177.42 1b9n s TYR 250 N -0.64 0.06 -0.06 0.00 1.13 0.07 -0.31 117.35 117.60 1b9n s TYR 250 Ca 0.40 -0.13 -0.31 0.00 -1.41 0.00 0.00 57.07 55.62 1b9n s TYR 250 Cb -0.23 -0.06 0.07 0.00 -1.10 0.00 0.00 41.96 40.64 1b9n s TYR 250 CO 0.28 -0.21 0.69 -0.59 -2.51 0.00 0.00 175.55 173.20 1b9n s PHE 251 N -1.06 -0.66 0.64 -3.49 -0.71 -0.96 -0.61 117.98 111.12 1b9n s PHE 251 Ca -0.12 1.16 -0.16 0.00 -1.04 0.00 0.00 56.93 56.77 1b9n s PHE 251 Cb -0.07 0.40 -0.01 0.00 -1.21 0.00 0.00 43.02 42.14 1b9n s PHE 251 CO 0.01 -0.60 1.13 -0.80 -1.34 0.00 0.00 175.22 173.61 1b9n s ASN 252 N -1.12 5.17 0.33 1.98 -0.87 -1.26 -1.50 114.94 117.66 1b9n s ASN 252 Ca -0.10 2.08 0.04 0.00 -1.57 0.00 0.00 52.86 53.31 1b9n s ASN 252 Cb -0.00 -2.56 0.58 0.00 -0.02 0.00 0.00 41.25 39.24 1b9n s ASN 252 CO 0.10 -1.59 1.85 0.00 -2.57 0.00 0.00 177.10 174.88 1b9n h ALA 253 N 0.29 1.33 -0.17 0.60 0.00 -1.91 -1.57 119.26 117.84 1b9n h ALA 253 Ca -0.48 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.21 1b9n h ALA 253 Cb 1.26 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1b9n h ALA 253 CO 0.54 0.45 0.00 -0.40 0.00 0.00 0.00 179.25 179.85 1b9n n ASP 254 N -4.25 0.95 0.10 0.00 5.75 -1.26 -1.05 116.55 116.78 1b9n n ASP 254 Ca 0.01 -1.93 0.05 0.00 -0.01 0.00 0.00 54.79 52.91 1b9n n ASP 254 Cb 0.27 -0.11 -0.01 0.00 -1.03 0.00 0.00 41.12 40.25 1b9n n ASP 254 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 1b9n h SER 255 N 1.07 0.00 -3.58 -1.12 0.02 -1.66 -3.47 113.55 104.81 1b9n h SER 255 Ca 0.00 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 60.43 1b9n h SER 255 Cb 0.24 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.76 1b9n h SER 255 CO 0.00 0.36 0.29 -0.69 -1.14 0.00 0.00 176.83 175.65 1b9n s VAL 256 N -3.07 4.42 -0.17 2.27 1.01 -1.22 -4.82 120.40 118.83 1b9n s VAL 256 Ca 0.01 1.93 -0.09 0.00 0.00 0.00 0.00 61.98 63.83 1b9n s VAL 256 Cb 0.08 -4.26 -0.05 0.00 0.00 0.00 0.00 36.38 32.16 1b9n s VAL 256 CO 0.77 0.40 0.14 -0.63 0.00 0.00 0.00 175.10 175.78 1b9n s ILE 257 N -0.48 5.44 -0.07 2.22 1.01 -0.56 -4.83 121.20 123.94 1b9n s ILE 257 Ca 0.42 0.21 0.04 0.00 0.00 0.00 0.00 60.65 61.32 1b9n s ILE 257 Cb -0.23 -3.45 -0.02 0.00 0.01 0.00 0.00 42.46 38.77 1b9n s ILE 257 CO 0.28 0.51 -0.19 -0.51 0.00 0.00 0.00 174.94 175.04 1b9n s ILE 258 N -0.20 2.62 0.14 2.92 2.07 -1.26 -1.28 121.20 126.21 1b9n s ILE 258 Ca 0.11 -0.86 0.08 0.00 -1.41 0.00 0.00 60.65 58.57 1b9n s ILE 258 Cb -0.11 -2.01 -0.04 0.00 0.13 0.00 0.00 42.46 40.42 1b9n s ILE 258 CO 0.01 0.57 -0.18 0.00 -1.91 0.00 0.00 174.94 173.43 1b9n s ALA 259 N -0.27 1.82 0.06 1.50 0.00 0.40 -4.95 121.76 120.33 1b9n s ALA 259 Ca 0.01 -1.37 0.04 0.00 0.00 0.00 0.00 51.96 50.63 1b9n s ALA 259 Cb -0.13 -0.17 -0.03 0.00 0.00 0.00 0.00 23.12 22.79 1b9n s ALA 259 CO 0.03 0.23 -0.11 0.95 0.00 0.00 0.00 175.76 176.86 1b9n s THR 260 N -1.83 0.88 -0.15 0.00 -4.23 -1.26 0.22 115.64 109.26 1b9n s THR 260 Ca 0.11 -1.26 -0.02 0.00 -1.18 0.00 0.00 61.69 59.34 1b9n s THR 260 Cb -0.07 -0.94 -0.02 0.00 1.34 0.00 0.00 72.50 72.82 1b9n s THR 260 CO 0.05 -0.32 -0.08 -0.76 -0.54 0.00 0.00 174.62 172.97 1b9n s LEU 261 N -1.76 2.99 0.00 4.79 1.43 -1.26 -5.05 118.68 119.82 1b9n s LEU 261 Ca -0.04 -0.24 0.16 0.00 -1.03 0.00 0.00 54.13 52.98 1b9n s LEU 261 Cb -0.09 -1.71 0.13 0.00 0.03 0.00 0.00 46.19 44.55 1b9n s LEU 261 CO 0.01 0.15 1.00 0.00 0.23 0.00 0.00 176.35 177.74